git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12393 f3b2605a-c512-4ea7-a41b-209d697bcdaa
This commit is contained in:
sjplimp
108
bench/KEPLER/Makefile.cpu
Executable file
108
bench/KEPLER/Makefile.cpu
Executable file
@ -0,0 +1,108 @@
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|||||||
|
# linux = Shannon Linux box, Intel icc, OpenMPI, KISS FFTW
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||||||
|
|
||||||
|
SHELL = /bin/sh
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# compiler/linker settings
|
||||||
|
# specify flags and libraries needed for your compiler
|
||||||
|
|
||||||
|
CC = icc
|
||||||
|
CCFLAGS = -O
|
||||||
|
SHFLAGS = -fPIC
|
||||||
|
DEPFLAGS = -M
|
||||||
|
|
||||||
|
LINK = icc
|
||||||
|
LINKFLAGS = -O
|
||||||
|
LIB = -lstdc++
|
||||||
|
SIZE = size
|
||||||
|
|
||||||
|
ARCHIVE = ar
|
||||||
|
ARFLAGS = -rc
|
||||||
|
SHLIBFLAGS = -shared
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# LAMMPS-specific settings
|
||||||
|
# specify settings for LAMMPS features you will use
|
||||||
|
# if you change any -D setting, do full re-compile after "make clean"
|
||||||
|
|
||||||
|
# LAMMPS ifdef settings, OPTIONAL
|
||||||
|
# see possible settings in doc/Section_start.html#2_2 (step 4)
|
||||||
|
|
||||||
|
LMP_INC =
|
||||||
|
|
||||||
|
# MPI library, REQUIRED
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 5)
|
||||||
|
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||||
|
# INC = path for mpi.h, MPI compiler settings
|
||||||
|
# PATH = path for MPI library
|
||||||
|
# LIB = name of MPI library
|
||||||
|
|
||||||
|
MPI_INC = -I/home/projects/openmpi/1.8.1/intel/13.1.SP1.106/cuda/6.0.37/include/
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||||||
|
MPI_PATH = -L/home/projects/openmpi/1.8.1/intel/13.1.SP1.106/cuda/6.0.37/lib
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||||||
|
MPI_LIB = -lmpi
|
||||||
|
|
||||||
|
# FFT library, OPTIONAL
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 6)
|
||||||
|
# can be left blank to use provided KISS FFT library
|
||||||
|
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||||
|
# PATH = path for FFT library
|
||||||
|
# LIB = name of FFT library
|
||||||
|
|
||||||
|
FFT_INC =
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||||||
|
FFT_PATH =
|
||||||
|
FFT_LIB =
|
||||||
|
|
||||||
|
# JPEG and/or PNG library, OPTIONAL
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 7)
|
||||||
|
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||||
|
# INC = path(s) for jpeglib.h and/or png.h
|
||||||
|
# PATH = path(s) for JPEG library and/or PNG library
|
||||||
|
# LIB = name(s) of JPEG library and/or PNG library
|
||||||
|
|
||||||
|
JPG_INC =
|
||||||
|
JPG_PATH =
|
||||||
|
JPG_LIB = -ljpeg
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# build rules and dependencies
|
||||||
|
# no need to edit this section
|
||||||
|
|
||||||
|
include Makefile.package.settings
|
||||||
|
include Makefile.package
|
||||||
|
|
||||||
|
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||||
|
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||||
|
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||||
|
|
||||||
|
# Path to src files
|
||||||
|
|
||||||
|
vpath %.cpp ..
|
||||||
|
vpath %.h ..
|
||||||
|
|
||||||
|
# Link target
|
||||||
|
|
||||||
|
$(EXE): $(OBJ)
|
||||||
|
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||||
|
$(SIZE) $(EXE)
|
||||||
|
|
||||||
|
# Library targets
|
||||||
|
|
||||||
|
lib: $(OBJ)
|
||||||
|
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||||
|
|
||||||
|
shlib: $(OBJ)
|
||||||
|
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||||
|
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||||
|
|
||||||
|
# Compilation rules
|
||||||
|
|
||||||
|
%.o:%.cpp
|
||||||
|
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||||
|
|
||||||
|
%.d:%.cpp
|
||||||
|
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||||
|
|
||||||
|
# Individual dependencies
|
||||||
|
|
||||||
|
DEPENDS = $(OBJ:.o=.d)
|
||||||
|
sinclude $(DEPENDS)
|
||||||
108
bench/KEPLER/Makefile.cuda
Executable file
108
bench/KEPLER/Makefile.cuda
Executable file
@ -0,0 +1,108 @@
|
|||||||
|
# linux = Shannon Linux box, Intel icc, OpenMPI, KISS FFTW
|
||||||
|
|
||||||
|
SHELL = /bin/sh
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# compiler/linker settings
|
||||||
|
# specify flags and libraries needed for your compiler
|
||||||
|
|
||||||
|
CC = icc
|
||||||
|
CCFLAGS = -O
|
||||||
|
SHFLAGS = -fPIC
|
||||||
|
DEPFLAGS = -M
|
||||||
|
|
||||||
|
LINK = icc
|
||||||
|
LINKFLAGS = -O
|
||||||
|
LIB = -lstdc++
|
||||||
|
SIZE = size
|
||||||
|
|
||||||
|
ARCHIVE = ar
|
||||||
|
ARFLAGS = -rc
|
||||||
|
SHLIBFLAGS = -shared
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# LAMMPS-specific settings
|
||||||
|
# specify settings for LAMMPS features you will use
|
||||||
|
# if you change any -D setting, do full re-compile after "make clean"
|
||||||
|
|
||||||
|
# LAMMPS ifdef settings, OPTIONAL
|
||||||
|
# see possible settings in doc/Section_start.html#2_2 (step 4)
|
||||||
|
|
||||||
|
LMP_INC =
|
||||||
|
|
||||||
|
# MPI library, REQUIRED
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 5)
|
||||||
|
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||||
|
# INC = path for mpi.h, MPI compiler settings
|
||||||
|
# PATH = path for MPI library
|
||||||
|
# LIB = name of MPI library
|
||||||
|
|
||||||
|
MPI_INC = -I/home/projects/openmpi/1.8.1/intel/13.1.SP1.106/cuda/6.0.37/include/
|
||||||
|
MPI_PATH = -L/home/projects/openmpi/1.8.1/intel/13.1.SP1.106/cuda/6.0.37/lib
|
||||||
|
MPI_LIB = -lmpi
|
||||||
|
|
||||||
|
# FFT library, OPTIONAL
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 6)
|
||||||
|
# can be left blank to use provided KISS FFT library
|
||||||
|
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||||
|
# PATH = path for FFT library
|
||||||
|
# LIB = name of FFT library
|
||||||
|
|
||||||
|
FFT_INC =
|
||||||
|
FFT_PATH =
|
||||||
|
FFT_LIB =
|
||||||
|
|
||||||
|
# JPEG and/or PNG library, OPTIONAL
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 7)
|
||||||
|
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||||
|
# INC = path(s) for jpeglib.h and/or png.h
|
||||||
|
# PATH = path(s) for JPEG library and/or PNG library
|
||||||
|
# LIB = name(s) of JPEG library and/or PNG library
|
||||||
|
|
||||||
|
JPG_INC =
|
||||||
|
JPG_PATH =
|
||||||
|
JPG_LIB = -ljpeg
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# build rules and dependencies
|
||||||
|
# no need to edit this section
|
||||||
|
|
||||||
|
include Makefile.package.settings
|
||||||
|
include Makefile.package
|
||||||
|
|
||||||
|
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||||
|
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||||
|
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||||
|
|
||||||
|
# Path to src files
|
||||||
|
|
||||||
|
vpath %.cpp ..
|
||||||
|
vpath %.h ..
|
||||||
|
|
||||||
|
# Link target
|
||||||
|
|
||||||
|
$(EXE): $(OBJ)
|
||||||
|
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||||
|
$(SIZE) $(EXE)
|
||||||
|
|
||||||
|
# Library targets
|
||||||
|
|
||||||
|
lib: $(OBJ)
|
||||||
|
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||||
|
|
||||||
|
shlib: $(OBJ)
|
||||||
|
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||||
|
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||||
|
|
||||||
|
# Compilation rules
|
||||||
|
|
||||||
|
%.o:%.cpp
|
||||||
|
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||||
|
|
||||||
|
%.d:%.cpp
|
||||||
|
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||||
|
|
||||||
|
# Individual dependencies
|
||||||
|
|
||||||
|
DEPENDS = $(OBJ:.o=.d)
|
||||||
|
sinclude $(DEPENDS)
|
||||||
108
bench/KEPLER/Makefile.gpu
Executable file
108
bench/KEPLER/Makefile.gpu
Executable file
@ -0,0 +1,108 @@
|
|||||||
|
# linux = Shannon Linux box, Intel icc, OpenMPI, KISS FFTW
|
||||||
|
|
||||||
|
SHELL = /bin/sh
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# compiler/linker settings
|
||||||
|
# specify flags and libraries needed for your compiler
|
||||||
|
|
||||||
|
CC = icc
|
||||||
|
CCFLAGS = -O
|
||||||
|
SHFLAGS = -fPIC
|
||||||
|
DEPFLAGS = -M
|
||||||
|
|
||||||
|
LINK = icc
|
||||||
|
LINKFLAGS = -O
|
||||||
|
LIB = -lstdc++
|
||||||
|
SIZE = size
|
||||||
|
|
||||||
|
ARCHIVE = ar
|
||||||
|
ARFLAGS = -rc
|
||||||
|
SHLIBFLAGS = -shared
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# LAMMPS-specific settings
|
||||||
|
# specify settings for LAMMPS features you will use
|
||||||
|
# if you change any -D setting, do full re-compile after "make clean"
|
||||||
|
|
||||||
|
# LAMMPS ifdef settings, OPTIONAL
|
||||||
|
# see possible settings in doc/Section_start.html#2_2 (step 4)
|
||||||
|
|
||||||
|
LMP_INC =
|
||||||
|
|
||||||
|
# MPI library, REQUIRED
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 5)
|
||||||
|
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||||
|
# INC = path for mpi.h, MPI compiler settings
|
||||||
|
# PATH = path for MPI library
|
||||||
|
# LIB = name of MPI library
|
||||||
|
|
||||||
|
MPI_INC = -I/home/projects/openmpi/1.8.1/intel/13.1.SP1.106/cuda/6.0.37/include/
|
||||||
|
MPI_PATH = -L/home/projects/openmpi/1.8.1/intel/13.1.SP1.106/cuda/6.0.37/lib
|
||||||
|
MPI_LIB = -lmpi
|
||||||
|
|
||||||
|
# FFT library, OPTIONAL
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 6)
|
||||||
|
# can be left blank to use provided KISS FFT library
|
||||||
|
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||||
|
# PATH = path for FFT library
|
||||||
|
# LIB = name of FFT library
|
||||||
|
|
||||||
|
FFT_INC =
|
||||||
|
FFT_PATH =
|
||||||
|
FFT_LIB =
|
||||||
|
|
||||||
|
# JPEG and/or PNG library, OPTIONAL
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 7)
|
||||||
|
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||||
|
# INC = path(s) for jpeglib.h and/or png.h
|
||||||
|
# PATH = path(s) for JPEG library and/or PNG library
|
||||||
|
# LIB = name(s) of JPEG library and/or PNG library
|
||||||
|
|
||||||
|
JPG_INC =
|
||||||
|
JPG_PATH =
|
||||||
|
JPG_LIB = -ljpeg
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# build rules and dependencies
|
||||||
|
# no need to edit this section
|
||||||
|
|
||||||
|
include Makefile.package.settings
|
||||||
|
include Makefile.package
|
||||||
|
|
||||||
|
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||||
|
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||||
|
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||||
|
|
||||||
|
# Path to src files
|
||||||
|
|
||||||
|
vpath %.cpp ..
|
||||||
|
vpath %.h ..
|
||||||
|
|
||||||
|
# Link target
|
||||||
|
|
||||||
|
$(EXE): $(OBJ)
|
||||||
|
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||||
|
$(SIZE) $(EXE)
|
||||||
|
|
||||||
|
# Library targets
|
||||||
|
|
||||||
|
lib: $(OBJ)
|
||||||
|
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||||
|
|
||||||
|
shlib: $(OBJ)
|
||||||
|
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||||
|
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||||
|
|
||||||
|
# Compilation rules
|
||||||
|
|
||||||
|
%.o:%.cpp
|
||||||
|
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||||
|
|
||||||
|
%.d:%.cpp
|
||||||
|
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||||
|
|
||||||
|
# Individual dependencies
|
||||||
|
|
||||||
|
DEPENDS = $(OBJ:.o=.d)
|
||||||
|
sinclude $(DEPENDS)
|
||||||
50
bench/KEPLER/Makefile.gpu.double
Normal file
50
bench/KEPLER/Makefile.gpu.double
Normal file
@ -0,0 +1,50 @@
|
|||||||
|
# /* ----------------------------------------------------------------------
|
||||||
|
# Generic Linux Makefile for CUDA
|
||||||
|
# - Change CUDA_ARCH for your GPU
|
||||||
|
# ------------------------------------------------------------------------- */
|
||||||
|
|
||||||
|
# which file will be copied to Makefile.lammps
|
||||||
|
|
||||||
|
EXTRAMAKE = Makefile.lammps.standard
|
||||||
|
|
||||||
|
CUDA_HOME = /home/projects/cuda/6.0.37
|
||||||
|
NVCC = nvcc
|
||||||
|
|
||||||
|
# Kepler CUDA
|
||||||
|
CUDA_ARCH = -arch=sm_35
|
||||||
|
# Tesla CUDA
|
||||||
|
#CUDA_ARCH = -arch=sm_21
|
||||||
|
# newer CUDA
|
||||||
|
#CUDA_ARCH = -arch=sm_13
|
||||||
|
# older CUDA
|
||||||
|
#CUDA_ARCH = -arch=sm_10 -DCUDA_PRE_THREE
|
||||||
|
|
||||||
|
# this setting should match LAMMPS Makefile
|
||||||
|
# one of LAMMPS_SMALLBIG (default), LAMMPS_BIGBIG and LAMMPS_SMALLSMALL
|
||||||
|
|
||||||
|
LMP_INC = -DLAMMPS_SMALLBIG
|
||||||
|
|
||||||
|
# precision for GPU calculations
|
||||||
|
# -D_SINGLE_SINGLE # Single precision for all calculations
|
||||||
|
# -D_DOUBLE_DOUBLE # Double precision for all calculations
|
||||||
|
# -D_SINGLE_DOUBLE # Accumulation of forces, etc. in double
|
||||||
|
|
||||||
|
CUDA_PRECISION = -D_DOUBLE_DOUBLE
|
||||||
|
|
||||||
|
CUDA_INCLUDE = -I$(CUDA_HOME)/include
|
||||||
|
CUDA_LIB = -L$(CUDA_HOME)/lib64
|
||||||
|
CUDA_OPTS = -DUNIX -O3 -Xptxas -v --use_fast_math
|
||||||
|
|
||||||
|
CUDR_CPP = mpic++ -DMPI_GERYON -DUCL_NO_EXIT -DMPICH_IGNORE_CXX_SEEK
|
||||||
|
CUDR_OPTS = -O2 # -xHost -no-prec-div -ansi-alias
|
||||||
|
|
||||||
|
BIN_DIR = ./
|
||||||
|
OBJ_DIR = ./
|
||||||
|
LIB_DIR = ./
|
||||||
|
AR = ar
|
||||||
|
BSH = /bin/sh
|
||||||
|
|
||||||
|
CUDPP_OPT = -DUSE_CUDPP -Icudpp_mini
|
||||||
|
|
||||||
|
include Nvidia.makefile
|
||||||
|
|
||||||
50
bench/KEPLER/Makefile.gpu.mixed
Normal file
50
bench/KEPLER/Makefile.gpu.mixed
Normal file
@ -0,0 +1,50 @@
|
|||||||
|
# /* ----------------------------------------------------------------------
|
||||||
|
# Generic Linux Makefile for CUDA
|
||||||
|
# - Change CUDA_ARCH for your GPU
|
||||||
|
# ------------------------------------------------------------------------- */
|
||||||
|
|
||||||
|
# which file will be copied to Makefile.lammps
|
||||||
|
|
||||||
|
EXTRAMAKE = Makefile.lammps.standard
|
||||||
|
|
||||||
|
CUDA_HOME = /home/projects/cuda/6.0.37
|
||||||
|
NVCC = nvcc
|
||||||
|
|
||||||
|
# Kepler CUDA
|
||||||
|
CUDA_ARCH = -arch=sm_35
|
||||||
|
# Tesla CUDA
|
||||||
|
#CUDA_ARCH = -arch=sm_21
|
||||||
|
# newer CUDA
|
||||||
|
#CUDA_ARCH = -arch=sm_13
|
||||||
|
# older CUDA
|
||||||
|
#CUDA_ARCH = -arch=sm_10 -DCUDA_PRE_THREE
|
||||||
|
|
||||||
|
# this setting should match LAMMPS Makefile
|
||||||
|
# one of LAMMPS_SMALLBIG (default), LAMMPS_BIGBIG and LAMMPS_SMALLSMALL
|
||||||
|
|
||||||
|
LMP_INC = -DLAMMPS_SMALLBIG
|
||||||
|
|
||||||
|
# precision for GPU calculations
|
||||||
|
# -D_SINGLE_SINGLE # Single precision for all calculations
|
||||||
|
# -D_DOUBLE_DOUBLE # Double precision for all calculations
|
||||||
|
# -D_SINGLE_DOUBLE # Accumulation of forces, etc. in double
|
||||||
|
|
||||||
|
CUDA_PRECISION = -D_SINGLE_DOUBLE
|
||||||
|
|
||||||
|
CUDA_INCLUDE = -I$(CUDA_HOME)/include
|
||||||
|
CUDA_LIB = -L$(CUDA_HOME)/lib64
|
||||||
|
CUDA_OPTS = -DUNIX -O3 -Xptxas -v --use_fast_math
|
||||||
|
|
||||||
|
CUDR_CPP = mpic++ -DMPI_GERYON -DUCL_NO_EXIT -DMPICH_IGNORE_CXX_SEEK
|
||||||
|
CUDR_OPTS = -O2 # -xHost -no-prec-div -ansi-alias
|
||||||
|
|
||||||
|
BIN_DIR = ./
|
||||||
|
OBJ_DIR = ./
|
||||||
|
LIB_DIR = ./
|
||||||
|
AR = ar
|
||||||
|
BSH = /bin/sh
|
||||||
|
|
||||||
|
CUDPP_OPT = -DUSE_CUDPP -Icudpp_mini
|
||||||
|
|
||||||
|
include Nvidia.makefile
|
||||||
|
|
||||||
50
bench/KEPLER/Makefile.gpu.single
Normal file
50
bench/KEPLER/Makefile.gpu.single
Normal file
@ -0,0 +1,50 @@
|
|||||||
|
# /* ----------------------------------------------------------------------
|
||||||
|
# Generic Linux Makefile for CUDA
|
||||||
|
# - Change CUDA_ARCH for your GPU
|
||||||
|
# ------------------------------------------------------------------------- */
|
||||||
|
|
||||||
|
# which file will be copied to Makefile.lammps
|
||||||
|
|
||||||
|
EXTRAMAKE = Makefile.lammps.standard
|
||||||
|
|
||||||
|
CUDA_HOME = /home/projects/cuda/6.0.37
|
||||||
|
NVCC = nvcc
|
||||||
|
|
||||||
|
# Kepler CUDA
|
||||||
|
CUDA_ARCH = -arch=sm_35
|
||||||
|
# Tesla CUDA
|
||||||
|
#CUDA_ARCH = -arch=sm_21
|
||||||
|
# newer CUDA
|
||||||
|
#CUDA_ARCH = -arch=sm_13
|
||||||
|
# older CUDA
|
||||||
|
#CUDA_ARCH = -arch=sm_10 -DCUDA_PRE_THREE
|
||||||
|
|
||||||
|
# this setting should match LAMMPS Makefile
|
||||||
|
# one of LAMMPS_SMALLBIG (default), LAMMPS_BIGBIG and LAMMPS_SMALLSMALL
|
||||||
|
|
||||||
|
LMP_INC = -DLAMMPS_SMALLBIG
|
||||||
|
|
||||||
|
# precision for GPU calculations
|
||||||
|
# -D_SINGLE_SINGLE # Single precision for all calculations
|
||||||
|
# -D_DOUBLE_DOUBLE # Double precision for all calculations
|
||||||
|
# -D_SINGLE_DOUBLE # Accumulation of forces, etc. in double
|
||||||
|
|
||||||
|
CUDA_PRECISION = -D_SINGLE_SINGLE
|
||||||
|
|
||||||
|
CUDA_INCLUDE = -I$(CUDA_HOME)/include
|
||||||
|
CUDA_LIB = -L$(CUDA_HOME)/lib64
|
||||||
|
CUDA_OPTS = -DUNIX -O3 -Xptxas -v --use_fast_math
|
||||||
|
|
||||||
|
CUDR_CPP = mpic++ -DMPI_GERYON -DUCL_NO_EXIT -DMPICH_IGNORE_CXX_SEEK
|
||||||
|
CUDR_OPTS = -O2 # -xHost -no-prec-div -ansi-alias
|
||||||
|
|
||||||
|
BIN_DIR = ./
|
||||||
|
OBJ_DIR = ./
|
||||||
|
LIB_DIR = ./
|
||||||
|
AR = ar
|
||||||
|
BSH = /bin/sh
|
||||||
|
|
||||||
|
CUDPP_OPT = -DUSE_CUDPP -Icudpp_mini
|
||||||
|
|
||||||
|
include Nvidia.makefile
|
||||||
|
|
||||||
109
bench/KEPLER/Makefile.intel.cpu
Executable file
109
bench/KEPLER/Makefile.intel.cpu
Executable file
@ -0,0 +1,109 @@
|
|||||||
|
# linux = Shannon Linux box, Intel icc, OpenMPI, KISS FFTW
|
||||||
|
|
||||||
|
SHELL = /bin/sh
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# compiler/linker settings
|
||||||
|
# specify flags and libraries needed for your compiler
|
||||||
|
|
||||||
|
CC = icc
|
||||||
|
CCFLAGS = -O3 -openmp -DLAMMPS_MEMALIGN=64 -no-offload \
|
||||||
|
-xHost -fno-alias -ansi-alias -restrict -override-limits
|
||||||
|
SHFLAGS = -fPIC
|
||||||
|
DEPFLAGS = -M
|
||||||
|
|
||||||
|
LINK = icc
|
||||||
|
LINKFLAGS = -O -openmp
|
||||||
|
LIB = -lstdc++
|
||||||
|
SIZE = size
|
||||||
|
|
||||||
|
ARCHIVE = ar
|
||||||
|
ARFLAGS = -rc
|
||||||
|
SHLIBFLAGS = -shared
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# LAMMPS-specific settings
|
||||||
|
# specify settings for LAMMPS features you will use
|
||||||
|
# if you change any -D setting, do full re-compile after "make clean"
|
||||||
|
|
||||||
|
# LAMMPS ifdef settings, OPTIONAL
|
||||||
|
# see possible settings in doc/Section_start.html#2_2 (step 4)
|
||||||
|
|
||||||
|
LMP_INC = -DLAMMPS_GZIP -DLAMMPS_JPEG
|
||||||
|
|
||||||
|
# MPI library, REQUIRED
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 5)
|
||||||
|
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||||
|
# INC = path for mpi.h, MPI compiler settings
|
||||||
|
# PATH = path for MPI library
|
||||||
|
# LIB = name of MPI library
|
||||||
|
|
||||||
|
MPI_INC = -I/home/projects/openmpi/1.8.1/intel/13.1.SP1.106/cuda/6.0.37/include/
|
||||||
|
MPI_PATH = -L/home/projects/openmpi/1.8.1/intel/13.1.SP1.106/cuda/6.0.37/lib
|
||||||
|
MPI_LIB = -lmpi
|
||||||
|
|
||||||
|
# FFT library, OPTIONAL
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 6)
|
||||||
|
# can be left blank to use provided KISS FFT library
|
||||||
|
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||||
|
# PATH = path for FFT library
|
||||||
|
# LIB = name of FFT library
|
||||||
|
|
||||||
|
FFT_INC =
|
||||||
|
FFT_PATH =
|
||||||
|
FFT_LIB =
|
||||||
|
|
||||||
|
# JPEG and/or PNG library, OPTIONAL
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 7)
|
||||||
|
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||||
|
# INC = path(s) for jpeglib.h and/or png.h
|
||||||
|
# PATH = path(s) for JPEG library and/or PNG library
|
||||||
|
# LIB = name(s) of JPEG library and/or PNG library
|
||||||
|
|
||||||
|
JPG_INC =
|
||||||
|
JPG_PATH =
|
||||||
|
JPG_LIB = -ljpeg
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# build rules and dependencies
|
||||||
|
# no need to edit this section
|
||||||
|
|
||||||
|
include Makefile.package.settings
|
||||||
|
include Makefile.package
|
||||||
|
|
||||||
|
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||||
|
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||||
|
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||||
|
|
||||||
|
# Path to src files
|
||||||
|
|
||||||
|
vpath %.cpp ..
|
||||||
|
vpath %.h ..
|
||||||
|
|
||||||
|
# Link target
|
||||||
|
|
||||||
|
$(EXE): $(OBJ)
|
||||||
|
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||||
|
$(SIZE) $(EXE)
|
||||||
|
|
||||||
|
# Library targets
|
||||||
|
|
||||||
|
lib: $(OBJ)
|
||||||
|
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||||
|
|
||||||
|
shlib: $(OBJ)
|
||||||
|
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||||
|
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||||
|
|
||||||
|
# Compilation rules
|
||||||
|
|
||||||
|
%.o:%.cpp
|
||||||
|
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||||
|
|
||||||
|
%.d:%.cpp
|
||||||
|
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||||
|
|
||||||
|
# Individual dependencies
|
||||||
|
|
||||||
|
DEPENDS = $(OBJ:.o=.d)
|
||||||
|
sinclude $(DEPENDS)
|
||||||
113
bench/KEPLER/Makefile.kokkos.cuda
Executable file
113
bench/KEPLER/Makefile.kokkos.cuda
Executable file
@ -0,0 +1,113 @@
|
|||||||
|
# linux = Shannon Linux box, Intel icc, OpenMPI, KISS FFTW
|
||||||
|
|
||||||
|
SHELL = /bin/sh
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# compiler/linker settings
|
||||||
|
# specify flags and libraries needed for your compiler
|
||||||
|
|
||||||
|
CC = nvcc
|
||||||
|
CCFLAGS = -O3 -arch=sm_35
|
||||||
|
SHFLAGS = -fPIC
|
||||||
|
DEPFLAGS = -M
|
||||||
|
|
||||||
|
LINK = mpicxx
|
||||||
|
LINKFLAGS = -O
|
||||||
|
LIB = -lstdc++
|
||||||
|
SIZE = size
|
||||||
|
|
||||||
|
ARCHIVE = ar
|
||||||
|
ARFLAGS = -rc
|
||||||
|
SHLIBFLAGS = -shared
|
||||||
|
|
||||||
|
OMP = yes
|
||||||
|
CUDA = yes
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# LAMMPS-specific settings
|
||||||
|
# specify settings for LAMMPS features you will use
|
||||||
|
# if you change any -D setting, do full re-compile after "make clean"
|
||||||
|
|
||||||
|
# LAMMPS ifdef settings, OPTIONAL
|
||||||
|
# see possible settings in doc/Section_start.html#2_2 (step 4)
|
||||||
|
|
||||||
|
LMP_INC =
|
||||||
|
|
||||||
|
# MPI library, REQUIRED
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 5)
|
||||||
|
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||||
|
# INC = path for mpi.h, MPI compiler settings
|
||||||
|
# PATH = path for MPI library
|
||||||
|
# LIB = name of MPI library
|
||||||
|
|
||||||
|
MPI_INC = -I/home/projects/openmpi/1.8.1/intel/13.1.SP1.106/cuda/6.0.37/include/
|
||||||
|
MPI_PATH = -L/home/projects/openmpi/1.8.1/intel/13.1.SP1.106/cuda/6.0.37/lib
|
||||||
|
MPI_LIB = -lmpi
|
||||||
|
|
||||||
|
# FFT library, OPTIONAL
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 6)
|
||||||
|
# can be left blank to use provided KISS FFT library
|
||||||
|
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||||
|
# PATH = path for FFT library
|
||||||
|
# LIB = name of FFT library
|
||||||
|
|
||||||
|
FFT_INC =
|
||||||
|
FFT_PATH =
|
||||||
|
FFT_LIB =
|
||||||
|
|
||||||
|
# JPEG and/or PNG library, OPTIONAL
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 7)
|
||||||
|
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||||
|
# INC = path(s) for jpeglib.h and/or png.h
|
||||||
|
# PATH = path(s) for JPEG library and/or PNG library
|
||||||
|
# LIB = name(s) of JPEG library and/or PNG library
|
||||||
|
|
||||||
|
JPG_INC =
|
||||||
|
JPG_PATH =
|
||||||
|
JPG_LIB = -ljpeg
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# build rules and dependencies
|
||||||
|
# no need to edit this section
|
||||||
|
|
||||||
|
include Makefile.package.settings
|
||||||
|
include Makefile.package
|
||||||
|
|
||||||
|
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||||
|
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||||
|
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||||
|
|
||||||
|
# Path to src files
|
||||||
|
|
||||||
|
vpath %.cpp ..
|
||||||
|
vpath %.h ..
|
||||||
|
|
||||||
|
# Link target
|
||||||
|
|
||||||
|
$(EXE): $(OBJ)
|
||||||
|
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||||
|
$(SIZE) $(EXE)
|
||||||
|
|
||||||
|
# Library targets
|
||||||
|
|
||||||
|
lib: $(OBJ)
|
||||||
|
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||||
|
|
||||||
|
shlib: $(OBJ)
|
||||||
|
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||||
|
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||||
|
|
||||||
|
# Compilation rules
|
||||||
|
%.o:%.cu
|
||||||
|
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||||
|
|
||||||
|
%.o:%.cpp
|
||||||
|
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||||
|
|
||||||
|
%.d:%.cpp
|
||||||
|
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||||
|
|
||||||
|
# Individual dependencies
|
||||||
|
|
||||||
|
DEPENDS = $(OBJ:.o=.d)
|
||||||
|
sinclude $(DEPENDS)
|
||||||
110
bench/KEPLER/Makefile.kokkos.omp
Executable file
110
bench/KEPLER/Makefile.kokkos.omp
Executable file
@ -0,0 +1,110 @@
|
|||||||
|
# linux = Shannon Linux box, Intel icc, OpenMPI, KISS FFTW
|
||||||
|
|
||||||
|
SHELL = /bin/sh
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# compiler/linker settings
|
||||||
|
# specify flags and libraries needed for your compiler
|
||||||
|
|
||||||
|
CC = icc
|
||||||
|
CCFLAGS = -O
|
||||||
|
SHFLAGS = -fPIC
|
||||||
|
DEPFLAGS = -M
|
||||||
|
|
||||||
|
LINK = icc
|
||||||
|
LINKFLAGS = -O
|
||||||
|
LIB = -lstdc++
|
||||||
|
SIZE = size
|
||||||
|
|
||||||
|
ARCHIVE = ar
|
||||||
|
ARFLAGS = -rc
|
||||||
|
SHLIBFLAGS = -shared
|
||||||
|
|
||||||
|
OMP = yes
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# LAMMPS-specific settings
|
||||||
|
# specify settings for LAMMPS features you will use
|
||||||
|
# if you change any -D setting, do full re-compile after "make clean"
|
||||||
|
|
||||||
|
# LAMMPS ifdef settings, OPTIONAL
|
||||||
|
# see possible settings in doc/Section_start.html#2_2 (step 4)
|
||||||
|
|
||||||
|
LMP_INC =
|
||||||
|
|
||||||
|
# MPI library, REQUIRED
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 5)
|
||||||
|
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||||
|
# INC = path for mpi.h, MPI compiler settings
|
||||||
|
# PATH = path for MPI library
|
||||||
|
# LIB = name of MPI library
|
||||||
|
|
||||||
|
MPI_INC = -I/home/projects/openmpi/1.8.1/intel/13.1.SP1.106/cuda/6.0.37/include/
|
||||||
|
MPI_PATH = -L/home/projects/openmpi/1.8.1/intel/13.1.SP1.106/cuda/6.0.37/lib
|
||||||
|
MPI_LIB = -lmpi
|
||||||
|
|
||||||
|
# FFT library, OPTIONAL
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 6)
|
||||||
|
# can be left blank to use provided KISS FFT library
|
||||||
|
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||||
|
# PATH = path for FFT library
|
||||||
|
# LIB = name of FFT library
|
||||||
|
|
||||||
|
FFT_INC =
|
||||||
|
FFT_PATH =
|
||||||
|
FFT_LIB =
|
||||||
|
|
||||||
|
# JPEG and/or PNG library, OPTIONAL
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 7)
|
||||||
|
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||||
|
# INC = path(s) for jpeglib.h and/or png.h
|
||||||
|
# PATH = path(s) for JPEG library and/or PNG library
|
||||||
|
# LIB = name(s) of JPEG library and/or PNG library
|
||||||
|
|
||||||
|
JPG_INC =
|
||||||
|
JPG_PATH =
|
||||||
|
JPG_LIB = -ljpeg
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# build rules and dependencies
|
||||||
|
# no need to edit this section
|
||||||
|
|
||||||
|
include Makefile.package.settings
|
||||||
|
include Makefile.package
|
||||||
|
|
||||||
|
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||||
|
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||||
|
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||||
|
|
||||||
|
# Path to src files
|
||||||
|
|
||||||
|
vpath %.cpp ..
|
||||||
|
vpath %.h ..
|
||||||
|
|
||||||
|
# Link target
|
||||||
|
|
||||||
|
$(EXE): $(OBJ)
|
||||||
|
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||||
|
$(SIZE) $(EXE)
|
||||||
|
|
||||||
|
# Library targets
|
||||||
|
|
||||||
|
lib: $(OBJ)
|
||||||
|
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||||
|
|
||||||
|
shlib: $(OBJ)
|
||||||
|
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||||
|
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||||
|
|
||||||
|
# Compilation rules
|
||||||
|
|
||||||
|
%.o:%.cpp
|
||||||
|
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||||
|
|
||||||
|
%.d:%.cpp
|
||||||
|
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||||
|
|
||||||
|
# Individual dependencies
|
||||||
|
|
||||||
|
DEPENDS = $(OBJ:.o=.d)
|
||||||
|
sinclude $(DEPENDS)
|
||||||
108
bench/KEPLER/Makefile.omp
Executable file
108
bench/KEPLER/Makefile.omp
Executable file
@ -0,0 +1,108 @@
|
|||||||
|
# linux = Shannon Linux box, Intel icc, OpenMPI, KISS FFTW
|
||||||
|
|
||||||
|
SHELL = /bin/sh
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# compiler/linker settings
|
||||||
|
# specify flags and libraries needed for your compiler
|
||||||
|
|
||||||
|
CC = icc
|
||||||
|
CCFLAGS = -O3 -openmp -ansi-alias
|
||||||
|
SHFLAGS = -fPIC
|
||||||
|
DEPFLAGS = -M
|
||||||
|
|
||||||
|
LINK = icc
|
||||||
|
LINKFLAGS = -O -openmp
|
||||||
|
LIB = -lstdc++
|
||||||
|
SIZE = size
|
||||||
|
|
||||||
|
ARCHIVE = ar
|
||||||
|
ARFLAGS = -rc
|
||||||
|
SHLIBFLAGS = -shared
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# LAMMPS-specific settings
|
||||||
|
# specify settings for LAMMPS features you will use
|
||||||
|
# if you change any -D setting, do full re-compile after "make clean"
|
||||||
|
|
||||||
|
# LAMMPS ifdef settings, OPTIONAL
|
||||||
|
# see possible settings in doc/Section_start.html#2_2 (step 4)
|
||||||
|
|
||||||
|
LMP_INC =
|
||||||
|
|
||||||
|
# MPI library, REQUIRED
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 5)
|
||||||
|
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||||
|
# INC = path for mpi.h, MPI compiler settings
|
||||||
|
# PATH = path for MPI library
|
||||||
|
# LIB = name of MPI library
|
||||||
|
|
||||||
|
MPI_INC = -I/home/projects/openmpi/1.8.1/intel/13.1.SP1.106/cuda/6.0.37/include/
|
||||||
|
MPI_PATH = -L/home/projects/openmpi/1.8.1/intel/13.1.SP1.106/cuda/6.0.37/lib
|
||||||
|
MPI_LIB = -lmpi
|
||||||
|
|
||||||
|
# FFT library, OPTIONAL
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 6)
|
||||||
|
# can be left blank to use provided KISS FFT library
|
||||||
|
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||||
|
# PATH = path for FFT library
|
||||||
|
# LIB = name of FFT library
|
||||||
|
|
||||||
|
FFT_INC =
|
||||||
|
FFT_PATH =
|
||||||
|
FFT_LIB =
|
||||||
|
|
||||||
|
# JPEG and/or PNG library, OPTIONAL
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 7)
|
||||||
|
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||||
|
# INC = path(s) for jpeglib.h and/or png.h
|
||||||
|
# PATH = path(s) for JPEG library and/or PNG library
|
||||||
|
# LIB = name(s) of JPEG library and/or PNG library
|
||||||
|
|
||||||
|
JPG_INC =
|
||||||
|
JPG_PATH =
|
||||||
|
JPG_LIB = -ljpeg
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# build rules and dependencies
|
||||||
|
# no need to edit this section
|
||||||
|
|
||||||
|
include Makefile.package.settings
|
||||||
|
include Makefile.package
|
||||||
|
|
||||||
|
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||||
|
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||||
|
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||||
|
|
||||||
|
# Path to src files
|
||||||
|
|
||||||
|
vpath %.cpp ..
|
||||||
|
vpath %.h ..
|
||||||
|
|
||||||
|
# Link target
|
||||||
|
|
||||||
|
$(EXE): $(OBJ)
|
||||||
|
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||||
|
$(SIZE) $(EXE)
|
||||||
|
|
||||||
|
# Library targets
|
||||||
|
|
||||||
|
lib: $(OBJ)
|
||||||
|
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||||
|
|
||||||
|
shlib: $(OBJ)
|
||||||
|
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||||
|
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||||
|
|
||||||
|
# Compilation rules
|
||||||
|
|
||||||
|
%.o:%.cpp
|
||||||
|
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||||
|
|
||||||
|
%.d:%.cpp
|
||||||
|
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||||
|
|
||||||
|
# Individual dependencies
|
||||||
|
|
||||||
|
DEPENDS = $(OBJ:.o=.d)
|
||||||
|
sinclude $(DEPENDS)
|
||||||
108
bench/KEPLER/Makefile.opt
Executable file
108
bench/KEPLER/Makefile.opt
Executable file
@ -0,0 +1,108 @@
|
|||||||
|
# linux = Shannon Linux box, Intel icc, OpenMPI, KISS FFTW
|
||||||
|
|
||||||
|
SHELL = /bin/sh
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# compiler/linker settings
|
||||||
|
# specify flags and libraries needed for your compiler
|
||||||
|
|
||||||
|
CC = icc
|
||||||
|
CCFLAGS = -O
|
||||||
|
SHFLAGS = -fPIC
|
||||||
|
DEPFLAGS = -M
|
||||||
|
|
||||||
|
LINK = icc
|
||||||
|
LINKFLAGS = -O
|
||||||
|
LIB = -lstdc++
|
||||||
|
SIZE = size
|
||||||
|
|
||||||
|
ARCHIVE = ar
|
||||||
|
ARFLAGS = -rc
|
||||||
|
SHLIBFLAGS = -shared
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# LAMMPS-specific settings
|
||||||
|
# specify settings for LAMMPS features you will use
|
||||||
|
# if you change any -D setting, do full re-compile after "make clean"
|
||||||
|
|
||||||
|
# LAMMPS ifdef settings, OPTIONAL
|
||||||
|
# see possible settings in doc/Section_start.html#2_2 (step 4)
|
||||||
|
|
||||||
|
LMP_INC =
|
||||||
|
|
||||||
|
# MPI library, REQUIRED
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 5)
|
||||||
|
# can point to dummy MPI library in src/STUBS as in Makefile.serial
|
||||||
|
# INC = path for mpi.h, MPI compiler settings
|
||||||
|
# PATH = path for MPI library
|
||||||
|
# LIB = name of MPI library
|
||||||
|
|
||||||
|
MPI_INC = -I/home/projects/openmpi/1.8.1/intel/13.1.SP1.106/cuda/6.0.37/include/
|
||||||
|
MPI_PATH = -L/home/projects/openmpi/1.8.1/intel/13.1.SP1.106/cuda/6.0.37/lib
|
||||||
|
MPI_LIB = -lmpi
|
||||||
|
|
||||||
|
# FFT library, OPTIONAL
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 6)
|
||||||
|
# can be left blank to use provided KISS FFT library
|
||||||
|
# INC = -DFFT setting, e.g. -DFFT_FFTW, FFT compiler settings
|
||||||
|
# PATH = path for FFT library
|
||||||
|
# LIB = name of FFT library
|
||||||
|
|
||||||
|
FFT_INC =
|
||||||
|
FFT_PATH =
|
||||||
|
FFT_LIB =
|
||||||
|
|
||||||
|
# JPEG and/or PNG library, OPTIONAL
|
||||||
|
# see discussion in doc/Section_start.html#2_2 (step 7)
|
||||||
|
# only needed if -DLAMMPS_JPEG or -DLAMMPS_PNG listed with LMP_INC
|
||||||
|
# INC = path(s) for jpeglib.h and/or png.h
|
||||||
|
# PATH = path(s) for JPEG library and/or PNG library
|
||||||
|
# LIB = name(s) of JPEG library and/or PNG library
|
||||||
|
|
||||||
|
JPG_INC =
|
||||||
|
JPG_PATH =
|
||||||
|
JPG_LIB = -ljpeg
|
||||||
|
|
||||||
|
# ---------------------------------------------------------------------
|
||||||
|
# build rules and dependencies
|
||||||
|
# no need to edit this section
|
||||||
|
|
||||||
|
include Makefile.package.settings
|
||||||
|
include Makefile.package
|
||||||
|
|
||||||
|
EXTRA_INC = $(LMP_INC) $(PKG_INC) $(MPI_INC) $(FFT_INC) $(JPG_INC) $(PKG_SYSINC)
|
||||||
|
EXTRA_PATH = $(PKG_PATH) $(MPI_PATH) $(FFT_PATH) $(JPG_PATH) $(PKG_SYSPATH)
|
||||||
|
EXTRA_LIB = $(PKG_LIB) $(MPI_LIB) $(FFT_LIB) $(JPG_LIB) $(PKG_SYSLIB)
|
||||||
|
|
||||||
|
# Path to src files
|
||||||
|
|
||||||
|
vpath %.cpp ..
|
||||||
|
vpath %.h ..
|
||||||
|
|
||||||
|
# Link target
|
||||||
|
|
||||||
|
$(EXE): $(OBJ)
|
||||||
|
$(LINK) $(LINKFLAGS) $(EXTRA_PATH) $(OBJ) $(EXTRA_LIB) $(LIB) -o $(EXE)
|
||||||
|
$(SIZE) $(EXE)
|
||||||
|
|
||||||
|
# Library targets
|
||||||
|
|
||||||
|
lib: $(OBJ)
|
||||||
|
$(ARCHIVE) $(ARFLAGS) $(EXE) $(OBJ)
|
||||||
|
|
||||||
|
shlib: $(OBJ)
|
||||||
|
$(CC) $(CCFLAGS) $(SHFLAGS) $(SHLIBFLAGS) $(EXTRA_PATH) -o $(EXE) \
|
||||||
|
$(OBJ) $(EXTRA_LIB) $(LIB)
|
||||||
|
|
||||||
|
# Compilation rules
|
||||||
|
|
||||||
|
%.o:%.cpp
|
||||||
|
$(CC) $(CCFLAGS) $(SHFLAGS) $(EXTRA_INC) -c $<
|
||||||
|
|
||||||
|
%.d:%.cpp
|
||||||
|
$(CC) $(CCFLAGS) $(EXTRA_INC) $(DEPFLAGS) $< > $@
|
||||||
|
|
||||||
|
# Individual dependencies
|
||||||
|
|
||||||
|
DEPENDS = $(OBJ:.o=.d)
|
||||||
|
sinclude $(DEPENDS)
|
||||||
68
bench/KEPLER/README
Normal file
68
bench/KEPLER/README
Normal file
@ -0,0 +1,68 @@
|
|||||||
|
These are input scripts used to run versions of several of the
|
||||||
|
benchmarks in the top-level bench directory using the GPU and
|
||||||
|
USER-CUDA accelerator packages. The results of running these scripts
|
||||||
|
on two different machines (a desktop with 2 Tesla GPUs and the ORNL
|
||||||
|
Titan supercomputer) are shown on the "GPU (Fermi)" section of the
|
||||||
|
Benchmark page of the LAMMPS WWW site: lammps.sandia.gov/bench.
|
||||||
|
|
||||||
|
Examples are shown below of how to run these scripts. This assumes
|
||||||
|
you have built 3 executables with both the GPU and USER-CUDA packages
|
||||||
|
installed, e.g.
|
||||||
|
|
||||||
|
lmp_linux_single
|
||||||
|
lmp_linux_mixed
|
||||||
|
lmp_linux_double
|
||||||
|
|
||||||
|
The precision (single, mixed, double) refers to the GPU and USER-CUDA
|
||||||
|
pacakge precision. See the README files in the lib/gpu and lib/cuda
|
||||||
|
directories for instructions on how to build the packages with
|
||||||
|
different precisions. The doc/Section_accelerate.html file also has a
|
||||||
|
summary description.
|
||||||
|
|
||||||
|
------------------------------------------------------------------------
|
||||||
|
|
||||||
|
If the script has "cpu" in its name, it is meant to be run in CPU-only
|
||||||
|
mode (without using the GPU or USER-CUDA styles). For example:
|
||||||
|
|
||||||
|
mpirun -np 1 ../lmp_linux_double -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cpu
|
||||||
|
mpirun -np 12 ../lmp_linux_double -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
|
||||||
|
The "xyz" settings determine the problem size. The "t" setting
|
||||||
|
determines the number of timesteps.
|
||||||
|
|
||||||
|
------------------------------------------------------------------------
|
||||||
|
|
||||||
|
If the script has "gpu" in its name, it is meant to be run using
|
||||||
|
the GPU package. For example:
|
||||||
|
|
||||||
|
mpirun -np 12 ../lmp_linux_single -sf gpu -v g 1 -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.gpu
|
||||||
|
|
||||||
|
mpirun -np 8 ../lmp_linux_mixed -sf gpu -v g 2 -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.gpu
|
||||||
|
|
||||||
|
The "xyz" settings determine the problem size. The "t" setting
|
||||||
|
determines the number of timesteps. The "np" setting determines how
|
||||||
|
many MPI tasks per compute node the problem will run on, and the "g"
|
||||||
|
setting determines how many GPUs per compute node the problem will run
|
||||||
|
on, i.e. 1 or 2 in this case. Note that you can use more MPI tasks
|
||||||
|
than GPUs (both per compute node) with the GPU package.
|
||||||
|
|
||||||
|
------------------------------------------------------------------------
|
||||||
|
|
||||||
|
If the script has "cuda" in its name, it is meant to be run using
|
||||||
|
the USER-CUDA package. For example:
|
||||||
|
|
||||||
|
mpirun -np 1 ../lmp_linux_single -c on -sf cuda -v g 1 -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
|
||||||
|
mpirun -np 2 ../lmp_linux_double -c on -sf cuda -v g 2 -v x 32 -v y 64 -v z 64 -v t 100 < in.eam.cuda
|
||||||
|
|
||||||
|
The "xyz" settings determine the problem size. The "t" setting
|
||||||
|
determines the number of timesteps. The "np" setting determines how
|
||||||
|
many MPI tasks per compute node the problem will run on, and the "g"
|
||||||
|
setting determines how many GPUs per compute node the problem will run
|
||||||
|
on, i.e. 1 or 2 in this case. For the USER-CUDA package, the number
|
||||||
|
of MPI tasks and GPUs (both per compute node) must be equal.
|
||||||
|
|
||||||
|
------------------------------------------------------------------------
|
||||||
|
|
||||||
|
If the script has "titan" in its name, it was run on the Titan supercomputer
|
||||||
|
at ORNL.
|
||||||
181
bench/KEPLER/build.py
Normal file
181
bench/KEPLER/build.py
Normal file
@ -0,0 +1,181 @@
|
|||||||
|
#!/usr/local/bin/python
|
||||||
|
|
||||||
|
# Syntax: build.py target1 target2 ...
|
||||||
|
# targets:
|
||||||
|
# cpu, opt, omp,
|
||||||
|
# gpu/double, gpu/mixed, gpu/single,
|
||||||
|
# cuda/double, cuda/mixed, cuda/single,
|
||||||
|
# intel/cpu, intel/phi,
|
||||||
|
# kokkos/omp, kokkos/phi, kokkos/cuda
|
||||||
|
# gpu = gpu/double + gpu/mixed + gpu/single
|
||||||
|
# cuda = cuda/double + cuda/mixed + cuda/single
|
||||||
|
# intel = intel/cpu + intel/phi
|
||||||
|
# kokkos = kokkos/omp + kokkos/phi + kokkos/cuda
|
||||||
|
# all = cpu + opt + omp + gpu + cuda + intel + kokkos
|
||||||
|
|
||||||
|
# create exectuables for different packages
|
||||||
|
# MUST set lmpdir to path of LAMMPS home directory
|
||||||
|
|
||||||
|
import sys,commands,os
|
||||||
|
|
||||||
|
lmpdir = "~/lammps"
|
||||||
|
|
||||||
|
# build LAMMPS
|
||||||
|
# copy makefile into src/MAKE as Makefile.foo, then remove it
|
||||||
|
|
||||||
|
def build_lammps(makefile,pkg):
|
||||||
|
print "Building LAMMPS with %s and %s packages ..." % (makefile,pkg)
|
||||||
|
commands.getoutput("cp %s %s/src/MAKE/Makefile.foo" % (makefile,lmpdir))
|
||||||
|
cwd = os.getcwd()
|
||||||
|
os.chdir(os.path.expanduser(lmpdir + "/src"))
|
||||||
|
str = "make clean-foo"
|
||||||
|
txt = commands.getoutput(str)
|
||||||
|
str = "make no-all"
|
||||||
|
txt = commands.getoutput(str)
|
||||||
|
for package in pkg:
|
||||||
|
str = "make yes-%s" % package
|
||||||
|
txt = commands.getoutput(str)
|
||||||
|
print txt
|
||||||
|
str = "make -j 16 foo"
|
||||||
|
txt = commands.getoutput(str)
|
||||||
|
os.remove("MAKE/Makefile.foo")
|
||||||
|
os.chdir(cwd)
|
||||||
|
|
||||||
|
# build GPU library in LAMMPS
|
||||||
|
# copy makefile into lib/gpu as Makefile.foo, then remove it
|
||||||
|
|
||||||
|
def build_gpu(makefile):
|
||||||
|
print "Building GPU lib with %s ..." % makefile
|
||||||
|
commands.getoutput("cp %s %s/lib/gpu/Makefile.foo" % (makefile,lmpdir))
|
||||||
|
cwd = os.getcwd()
|
||||||
|
os.chdir(os.path.expanduser(lmpdir + "/lib/gpu"))
|
||||||
|
str = "make -f Makefile.foo clean"
|
||||||
|
txt = commands.getoutput(str)
|
||||||
|
str = "make -j 16 -f Makefile.foo"
|
||||||
|
txt = commands.getoutput(str)
|
||||||
|
os.remove("Makefile.foo")
|
||||||
|
os.chdir(cwd)
|
||||||
|
|
||||||
|
# build CUDA library in LAMMPS
|
||||||
|
# set precision and arch explicitly as options to make in lib/cuda
|
||||||
|
|
||||||
|
def build_cuda(precision,arch):
|
||||||
|
print "Building USER-CUDA lib with %s and arch sm_%d ..." % (precision,arch)
|
||||||
|
cwd = os.getcwd()
|
||||||
|
os.chdir(os.path.expanduser(lmpdir + "/lib/cuda"))
|
||||||
|
str = "make clean"
|
||||||
|
txt = commands.getoutput(str)
|
||||||
|
if precision == "double": pflag = 2
|
||||||
|
elif precision == "mixed": pflag = 4
|
||||||
|
elif precision == "single": pflag = 1
|
||||||
|
str = "make -j 16 precision=%d arch=%s" % (pflag,arch)
|
||||||
|
txt = commands.getoutput(str)
|
||||||
|
|
||||||
|
os.chdir(cwd)
|
||||||
|
|
||||||
|
# main program
|
||||||
|
# convert target keywords into target flags
|
||||||
|
|
||||||
|
cpu = opt = omp = 0
|
||||||
|
gpu_double = gpu_mixed = gpu_single = 0
|
||||||
|
cuda_double = cuda_mixed = cuda_single = 0
|
||||||
|
intel_cpu = intel_phi = 0
|
||||||
|
kokkos_omp = kokkos_phi = kokkos_cuda = 0
|
||||||
|
|
||||||
|
targets = sys.argv[1:]
|
||||||
|
for target in targets:
|
||||||
|
if target == "cpu": cpu = 1
|
||||||
|
elif target == "opt": opt = 1
|
||||||
|
elif target == "omp": omp = 1
|
||||||
|
elif target == "gpu/double": gpu_double = 1
|
||||||
|
elif target == "gpu/mixed": gpu_mixed = 1
|
||||||
|
elif target == "gpu/single": gpu_single = 1
|
||||||
|
elif target == "gpu": gpu_double = gpu_mixed = gpu_single = 1
|
||||||
|
elif target == "cuda/double": cuda_double = 1
|
||||||
|
elif target == "cuda/mixed": cuda_mixed = 1
|
||||||
|
elif target == "cuda/single": cuda_single = 1
|
||||||
|
elif target == "cuda": cuda_double = cuda_mixed = cuda_single = 1
|
||||||
|
elif target == "intel/cpu": intel_cpu = 1
|
||||||
|
elif target == "intel/phi": intel_phi = 1
|
||||||
|
elif target == "intel": intel_cpu = intel_phi = 1
|
||||||
|
elif target == "kokkos/omp": kokkos_omp = 1
|
||||||
|
elif target == "kokkos/phi": kokkos_phi = 1
|
||||||
|
elif target == "kokkos/cuda": kokkos_cuda = 1
|
||||||
|
elif target == "kokkos": kokkos_omp = kokkos_phi = kokkos_cuda = 1
|
||||||
|
else: print "Target",target,"is unknown"
|
||||||
|
|
||||||
|
# CPU
|
||||||
|
|
||||||
|
if cpu:
|
||||||
|
build_lammps(makefile = "Makefile.cpu", pkg = [])
|
||||||
|
print commands.getoutput("mv %s/src/lmp_foo ./lmp_cpu" % lmpdir)
|
||||||
|
|
||||||
|
# OPT
|
||||||
|
|
||||||
|
if opt:
|
||||||
|
build_lammps(makefile = "Makefile.opt", pkg = ["opt"])
|
||||||
|
print commands.getoutput("mv %s/src/lmp_foo ./lmp_opt" % lmpdir)
|
||||||
|
|
||||||
|
# OMP
|
||||||
|
|
||||||
|
if omp:
|
||||||
|
build_lammps(makefile = "Makefile.omp", pkg = ["user-omp"])
|
||||||
|
print commands.getoutput("mv %s/src/lmp_foo ./lmp_omp" % lmpdir)
|
||||||
|
|
||||||
|
# GPU, 3 precisions
|
||||||
|
|
||||||
|
if gpu_double:
|
||||||
|
build_gpu(makefile = "Makefile.gpu.double")
|
||||||
|
build_lammps(makefile = "Makefile.gpu", pkg = ["gpu"])
|
||||||
|
print commands.getoutput("mv %s/src/lmp_foo ./lmp_gpu_double" % lmpdir)
|
||||||
|
|
||||||
|
if gpu_mixed:
|
||||||
|
build_gpu(makefile = "Makefile.gpu.mixed")
|
||||||
|
build_lammps(makefile = "Makefile.gpu", pkg = ["gpu"])
|
||||||
|
print commands.getoutput("mv %s/src/lmp_foo ./lmp_gpu_mixed" % lmpdir)
|
||||||
|
|
||||||
|
if gpu_single:
|
||||||
|
build_gpu(makefile = "Makefile.gpu.single")
|
||||||
|
build_lammps(makefile = "Makefile.gpu", pkg = ["gpu"])
|
||||||
|
print commands.getoutput("mv %s/src/lmp_foo ./lmp_gpu_single" % lmpdir)
|
||||||
|
|
||||||
|
# CUDA, 3 precisions
|
||||||
|
|
||||||
|
if cuda_double:
|
||||||
|
build_cuda(precision = "double", arch = 35)
|
||||||
|
build_lammps(makefile = "Makefile.cuda", pkg = ["kspace","user-cuda"])
|
||||||
|
print commands.getoutput("mv %s/src/lmp_foo ./lmp_cuda_double" % lmpdir)
|
||||||
|
|
||||||
|
if cuda_mixed:
|
||||||
|
build_cuda(precision = "mixed", arch = 35)
|
||||||
|
build_lammps(makefile = "Makefile.cuda", pkg = ["kspace","user-cuda"])
|
||||||
|
print commands.getoutput("mv %s/src/lmp_foo ./lmp_cuda_mixed" % lmpdir)
|
||||||
|
|
||||||
|
if cuda_single:
|
||||||
|
build_cuda(precision = "single", arch = 35)
|
||||||
|
build_lammps(makefile = "Makefile.cuda", pkg = ["kspace","user-cuda"])
|
||||||
|
print commands.getoutput("mv %s/src/lmp_foo ./lmp_cuda_single" % lmpdir)
|
||||||
|
|
||||||
|
# INTEL, CPU and Phi
|
||||||
|
|
||||||
|
if intel_cpu:
|
||||||
|
build_lammps(makefile = "Makefile.intel.cpu", pkg = ["user-intel"])
|
||||||
|
print commands.getoutput("mv %s/src/lmp_foo ./lmp_intel_cpu" % lmpdir)
|
||||||
|
|
||||||
|
if intel_phi:
|
||||||
|
build_lammps(makefile = "Makefile.intel.phi", pkg = ["user-intel","user-omp"])
|
||||||
|
print commands.getoutput("mv %s/src/lmp_foo ./lmp_intel_phi" % lmpdir)
|
||||||
|
|
||||||
|
# KOKKOS, all variants
|
||||||
|
|
||||||
|
if kokkos_omp:
|
||||||
|
build_lammps(makefile = "Makefile.kokkos.omp", pkg = ["kokkos"])
|
||||||
|
print commands.getoutput("mv %s/src/lmp_foo ./lmp_kokkos_omp" % lmpdir)
|
||||||
|
|
||||||
|
if kokkos_phi:
|
||||||
|
build_lammps(makefile = "Makefile.kokkos.phi", pkg = ["kokkos"])
|
||||||
|
print commands.getoutput("mv %s/src/lmp_foo ./lmp_kokkos_phi" % lmpdir)
|
||||||
|
|
||||||
|
if kokkos_cuda:
|
||||||
|
build_lammps(makefile = "Makefile.kokkos.cuda", pkg = ["kokkos"])
|
||||||
|
print commands.getoutput("mv %s/src/lmp_foo ./lmp_kokkos_cuda" % lmpdir)
|
||||||
22
bench/KEPLER/in.lj.cpu
Normal file
22
bench/KEPLER/in.lj.cpu
Normal file
@ -0,0 +1,22 @@
|
|||||||
|
# 3d Lennard-Jones melt
|
||||||
|
|
||||||
|
units lj
|
||||||
|
atom_style atomic
|
||||||
|
|
||||||
|
lattice fcc 0.8442
|
||||||
|
region box block 0 $x 0 $y 0 $z
|
||||||
|
create_box 1 box
|
||||||
|
create_atoms 1 box
|
||||||
|
mass 1 1.0
|
||||||
|
|
||||||
|
velocity all create 1.44 87287 loop geom
|
||||||
|
|
||||||
|
pair_style lj/cut 2.5
|
||||||
|
pair_coeff 1 1 1.0 1.0 2.5
|
||||||
|
|
||||||
|
neighbor 0.3 bin
|
||||||
|
neigh_modify delay 0 every 20 check no
|
||||||
|
|
||||||
|
fix 1 all nve
|
||||||
|
|
||||||
|
run $t
|
||||||
26
bench/KEPLER/in.lj.cuda
Normal file
26
bench/KEPLER/in.lj.cuda
Normal file
@ -0,0 +1,26 @@
|
|||||||
|
# 3d Lennard-Jones melt
|
||||||
|
|
||||||
|
# set number of GPUs
|
||||||
|
|
||||||
|
package cuda gpu/node $g
|
||||||
|
|
||||||
|
units lj
|
||||||
|
atom_style atomic
|
||||||
|
|
||||||
|
lattice fcc 0.8442
|
||||||
|
region box block 0 $x 0 $y 0 $z
|
||||||
|
create_box 1 box
|
||||||
|
create_atoms 1 box
|
||||||
|
mass 1 1.0
|
||||||
|
|
||||||
|
velocity all create 1.44 87287 loop geom
|
||||||
|
|
||||||
|
pair_style lj/cut 2.5
|
||||||
|
pair_coeff 1 1 1.0 1.0 2.5
|
||||||
|
|
||||||
|
neighbor 0.3 bin
|
||||||
|
neigh_modify delay 0 every 20 check no
|
||||||
|
|
||||||
|
fix 1 all nve
|
||||||
|
|
||||||
|
run $t
|
||||||
29
bench/KEPLER/in.lj.gpu
Normal file
29
bench/KEPLER/in.lj.gpu
Normal file
@ -0,0 +1,29 @@
|
|||||||
|
# 3d Lennard-Jones melt
|
||||||
|
|
||||||
|
# newton off is required for GPU package
|
||||||
|
# set number of GPUs
|
||||||
|
|
||||||
|
newton off
|
||||||
|
if "$g == 1" then "package gpu force/neigh 0 0 1"
|
||||||
|
if "$g == 2" then "package gpu force/neigh 0 1 1"
|
||||||
|
|
||||||
|
units lj
|
||||||
|
atom_style atomic
|
||||||
|
|
||||||
|
lattice fcc 0.8442
|
||||||
|
region box block 0 $x 0 $y 0 $z
|
||||||
|
create_box 1 box
|
||||||
|
create_atoms 1 box
|
||||||
|
mass 1 1.0
|
||||||
|
|
||||||
|
velocity all create 1.44 87287 loop geom
|
||||||
|
|
||||||
|
pair_style lj/cut 2.5
|
||||||
|
pair_coeff 1 1 1.0 1.0 2.5
|
||||||
|
|
||||||
|
neighbor 0.3 bin
|
||||||
|
neigh_modify delay 0 every 20 check no
|
||||||
|
|
||||||
|
fix 1 all nve
|
||||||
|
|
||||||
|
run $t
|
||||||
26
bench/KEPLER/in.lj.intel.cpu
Normal file
26
bench/KEPLER/in.lj.intel.cpu
Normal file
@ -0,0 +1,26 @@
|
|||||||
|
# 3d Lennard-Jones melt
|
||||||
|
|
||||||
|
# set precision for USER-INTEL package
|
||||||
|
|
||||||
|
package intel 1 $a balance 0.0
|
||||||
|
|
||||||
|
units lj
|
||||||
|
atom_style atomic
|
||||||
|
|
||||||
|
lattice fcc 0.8442
|
||||||
|
region box block 0 $x 0 $y 0 $z
|
||||||
|
create_box 1 box
|
||||||
|
create_atoms 1 box
|
||||||
|
mass 1 1.0
|
||||||
|
|
||||||
|
velocity all create 1.44 87287 loop geom
|
||||||
|
|
||||||
|
pair_style lj/cut 2.5
|
||||||
|
pair_coeff 1 1 1.0 1.0 2.5
|
||||||
|
|
||||||
|
neighbor 0.3 bin
|
||||||
|
neigh_modify delay 0 every 20 check no
|
||||||
|
|
||||||
|
fix 1 all nve
|
||||||
|
|
||||||
|
run $t
|
||||||
29
bench/KEPLER/in.lj.kokkos.cuda
Normal file
29
bench/KEPLER/in.lj.kokkos.cuda
Normal file
@ -0,0 +1,29 @@
|
|||||||
|
# 3d Lennard-Jones melt
|
||||||
|
|
||||||
|
# set neighlist style and comm mode
|
||||||
|
|
||||||
|
package kokkos neigh full comm/exchange $c comm/forward $c
|
||||||
|
newton off
|
||||||
|
|
||||||
|
units lj
|
||||||
|
atom_style atomic
|
||||||
|
|
||||||
|
lattice fcc 0.8442
|
||||||
|
region box block 0 $x 0 $y 0 $z
|
||||||
|
create_box 1 box
|
||||||
|
create_atoms 1 box
|
||||||
|
mass 1 1.0
|
||||||
|
|
||||||
|
velocity all create 1.44 87287 loop geom
|
||||||
|
|
||||||
|
pair_style lj/cut 2.5
|
||||||
|
pair_coeff 1 1 1.0 1.0 2.5
|
||||||
|
|
||||||
|
# set neighbor bins to cutoff + skin
|
||||||
|
|
||||||
|
neighbor 0.3 bin
|
||||||
|
neigh_modify delay 0 every 20 check no binsize 2.8
|
||||||
|
|
||||||
|
fix 1 all nve
|
||||||
|
|
||||||
|
run $t
|
||||||
26
bench/KEPLER/in.lj.kokkos.omp
Normal file
26
bench/KEPLER/in.lj.kokkos.omp
Normal file
@ -0,0 +1,26 @@
|
|||||||
|
# 3d Lennard-Jones melt
|
||||||
|
|
||||||
|
# set neighlist style and comm mode
|
||||||
|
|
||||||
|
package kokkos neigh $n comm/exchange $c comm/forward $c
|
||||||
|
|
||||||
|
units lj
|
||||||
|
atom_style atomic
|
||||||
|
|
||||||
|
lattice fcc 0.8442
|
||||||
|
region box block 0 $x 0 $y 0 $z
|
||||||
|
create_box 1 box
|
||||||
|
create_atoms 1 box
|
||||||
|
mass 1 1.0
|
||||||
|
|
||||||
|
velocity all create 1.44 87287 loop geom
|
||||||
|
|
||||||
|
pair_style lj/cut 2.5
|
||||||
|
pair_coeff 1 1 1.0 1.0 2.5
|
||||||
|
|
||||||
|
neighbor 0.3 bin
|
||||||
|
neigh_modify delay 0 every 20 check no
|
||||||
|
|
||||||
|
fix 1 all nve
|
||||||
|
|
||||||
|
run $t
|
||||||
26
bench/KEPLER/in.lj.omp
Normal file
26
bench/KEPLER/in.lj.omp
Normal file
@ -0,0 +1,26 @@
|
|||||||
|
# 3d Lennard-Jones melt
|
||||||
|
|
||||||
|
# set number of threads per MPI task
|
||||||
|
|
||||||
|
package omp $h
|
||||||
|
|
||||||
|
units lj
|
||||||
|
atom_style atomic
|
||||||
|
|
||||||
|
lattice fcc 0.8442
|
||||||
|
region box block 0 $x 0 $y 0 $z
|
||||||
|
create_box 1 box
|
||||||
|
create_atoms 1 box
|
||||||
|
mass 1 1.0
|
||||||
|
|
||||||
|
velocity all create 1.44 87287 loop geom
|
||||||
|
|
||||||
|
pair_style lj/cut 2.5
|
||||||
|
pair_coeff 1 1 1.0 1.0 2.5
|
||||||
|
|
||||||
|
neighbor 0.3 bin
|
||||||
|
neigh_modify delay 0 every 20 check no
|
||||||
|
|
||||||
|
fix 1 all nve
|
||||||
|
|
||||||
|
run $t
|
||||||
22
bench/KEPLER/in.lj.opt
Normal file
22
bench/KEPLER/in.lj.opt
Normal file
@ -0,0 +1,22 @@
|
|||||||
|
# 3d Lennard-Jones melt
|
||||||
|
|
||||||
|
units lj
|
||||||
|
atom_style atomic
|
||||||
|
|
||||||
|
lattice fcc 0.8442
|
||||||
|
region box block 0 $x 0 $y 0 $z
|
||||||
|
create_box 1 box
|
||||||
|
create_atoms 1 box
|
||||||
|
mass 1 1.0
|
||||||
|
|
||||||
|
velocity all create 1.44 87287 loop geom
|
||||||
|
|
||||||
|
pair_style lj/cut 2.5
|
||||||
|
pair_coeff 1 1 1.0 1.0 2.5
|
||||||
|
|
||||||
|
neighbor 0.3 bin
|
||||||
|
neigh_modify delay 0 every 20 check no
|
||||||
|
|
||||||
|
fix 1 all nve
|
||||||
|
|
||||||
|
run $t
|
||||||
434
bench/KEPLER/run_cpu.sh
Normal file
434
bench/KEPLER/run_cpu.sh
Normal file
@ -0,0 +1,434 @@
|
|||||||
|
#!/bin/bash
|
||||||
|
#SBATCH -N 1 --time=12:00:00
|
||||||
|
|
||||||
|
mpirun -N 1 ./lmp_cpu -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2K.1
|
||||||
|
mpirun -N 1 ./lmp_cpu -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4K.1
|
||||||
|
mpirun -N 1 ./lmp_cpu -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8K.1
|
||||||
|
mpirun -N 1 ./lmp_cpu -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.16K.1
|
||||||
|
mpirun -N 1 ./lmp_cpu -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.32K.1
|
||||||
|
mpirun -N 1 ./lmp_cpu -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.64K.1
|
||||||
|
mpirun -N 1 ./lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.128K.1
|
||||||
|
mpirun -N 1 ./lmp_cpu -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.256K.1
|
||||||
|
mpirun -N 1 ./lmp_cpu -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.512K.1
|
||||||
|
mpirun -N 1 ./lmp_cpu -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.1024K.1
|
||||||
|
mpirun -N 1 ./lmp_cpu -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2048K.1
|
||||||
|
mpirun -N 1 ./lmp_cpu -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4096K.1
|
||||||
|
mpirun -N 1 ./lmp_cpu -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8192K.1
|
||||||
|
|
||||||
|
mpirun -N 2 ./lmp_cpu -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2K.2
|
||||||
|
mpirun -N 2 ./lmp_cpu -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4K.2
|
||||||
|
mpirun -N 2 ./lmp_cpu -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8K.2
|
||||||
|
mpirun -N 2 ./lmp_cpu -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.16K.2
|
||||||
|
mpirun -N 2 ./lmp_cpu -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.32K.2
|
||||||
|
mpirun -N 2 ./lmp_cpu -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.64K.2
|
||||||
|
mpirun -N 2 ./lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.128K.2
|
||||||
|
mpirun -N 2 ./lmp_cpu -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.256K.2
|
||||||
|
mpirun -N 2 ./lmp_cpu -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.512K.2
|
||||||
|
mpirun -N 2 ./lmp_cpu -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.1024K.2
|
||||||
|
mpirun -N 2 ./lmp_cpu -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2048K.2
|
||||||
|
mpirun -N 2 ./lmp_cpu -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4096K.2
|
||||||
|
mpirun -N 2 ./lmp_cpu -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8192K.2
|
||||||
|
|
||||||
|
mpirun -N 3 ./lmp_cpu -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2K.3
|
||||||
|
mpirun -N 3 ./lmp_cpu -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4K.3
|
||||||
|
mpirun -N 3 ./lmp_cpu -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8K.3
|
||||||
|
mpirun -N 3 ./lmp_cpu -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.16K.3
|
||||||
|
mpirun -N 3 ./lmp_cpu -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.32K.3
|
||||||
|
mpirun -N 3 ./lmp_cpu -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.64K.3
|
||||||
|
mpirun -N 3 ./lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.128K.3
|
||||||
|
mpirun -N 3 ./lmp_cpu -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.256K.3
|
||||||
|
mpirun -N 3 ./lmp_cpu -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.512K.3
|
||||||
|
mpirun -N 3 ./lmp_cpu -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.1024K.3
|
||||||
|
mpirun -N 3 ./lmp_cpu -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2048K.3
|
||||||
|
mpirun -N 3 ./lmp_cpu -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4096K.3
|
||||||
|
mpirun -N 3 ./lmp_cpu -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8192K.3
|
||||||
|
|
||||||
|
mpirun -N 4 ./lmp_cpu -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2K.4
|
||||||
|
mpirun -N 4 ./lmp_cpu -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4K.4
|
||||||
|
mpirun -N 4 ./lmp_cpu -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8K.4
|
||||||
|
mpirun -N 4 ./lmp_cpu -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.16K.4
|
||||||
|
mpirun -N 4 ./lmp_cpu -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.32K.4
|
||||||
|
mpirun -N 4 ./lmp_cpu -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.64K.4
|
||||||
|
mpirun -N 4 ./lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.128K.4
|
||||||
|
mpirun -N 4 ./lmp_cpu -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.256K.4
|
||||||
|
mpirun -N 4 ./lmp_cpu -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.512K.4
|
||||||
|
mpirun -N 4 ./lmp_cpu -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.1024K.4
|
||||||
|
mpirun -N 4 ./lmp_cpu -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2048K.4
|
||||||
|
mpirun -N 4 ./lmp_cpu -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4096K.4
|
||||||
|
mpirun -N 4 ./lmp_cpu -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8192K.4
|
||||||
|
|
||||||
|
mpirun -N 5 ./lmp_cpu -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2K.5
|
||||||
|
mpirun -N 5 ./lmp_cpu -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4K.5
|
||||||
|
mpirun -N 5 ./lmp_cpu -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8K.5
|
||||||
|
mpirun -N 5 ./lmp_cpu -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.16K.5
|
||||||
|
mpirun -N 5 ./lmp_cpu -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.32K.5
|
||||||
|
mpirun -N 5 ./lmp_cpu -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.64K.5
|
||||||
|
mpirun -N 5 ./lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.128K.5
|
||||||
|
mpirun -N 5 ./lmp_cpu -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.256K.5
|
||||||
|
mpirun -N 5 ./lmp_cpu -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.512K.5
|
||||||
|
mpirun -N 5 ./lmp_cpu -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.1024K.5
|
||||||
|
mpirun -N 5 ./lmp_cpu -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2048K.5
|
||||||
|
mpirun -N 5 ./lmp_cpu -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4096K.5
|
||||||
|
mpirun -N 5 ./lmp_cpu -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8192K.5
|
||||||
|
|
||||||
|
mpirun -N 6 ./lmp_cpu -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2K.6
|
||||||
|
mpirun -N 6 ./lmp_cpu -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4K.6
|
||||||
|
mpirun -N 6 ./lmp_cpu -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8K.6
|
||||||
|
mpirun -N 6 ./lmp_cpu -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.16K.6
|
||||||
|
mpirun -N 6 ./lmp_cpu -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.32K.6
|
||||||
|
mpirun -N 6 ./lmp_cpu -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.64K.6
|
||||||
|
mpirun -N 6 ./lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.128K.6
|
||||||
|
mpirun -N 6 ./lmp_cpu -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.256K.6
|
||||||
|
mpirun -N 6 ./lmp_cpu -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.512K.6
|
||||||
|
mpirun -N 6 ./lmp_cpu -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.1024K.6
|
||||||
|
mpirun -N 6 ./lmp_cpu -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2048K.6
|
||||||
|
mpirun -N 6 ./lmp_cpu -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4096K.6
|
||||||
|
mpirun -N 6 ./lmp_cpu -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8192K.6
|
||||||
|
|
||||||
|
mpirun -N 7 ./lmp_cpu -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2K.7
|
||||||
|
mpirun -N 7 ./lmp_cpu -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4K.7
|
||||||
|
mpirun -N 7 ./lmp_cpu -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8K.7
|
||||||
|
mpirun -N 7 ./lmp_cpu -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.16K.7
|
||||||
|
mpirun -N 7 ./lmp_cpu -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.32K.7
|
||||||
|
mpirun -N 7 ./lmp_cpu -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.64K.7
|
||||||
|
mpirun -N 7 ./lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.128K.7
|
||||||
|
mpirun -N 7 ./lmp_cpu -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.256K.7
|
||||||
|
mpirun -N 7 ./lmp_cpu -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.512K.7
|
||||||
|
mpirun -N 7 ./lmp_cpu -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.1024K.7
|
||||||
|
mpirun -N 7 ./lmp_cpu -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2048K.7
|
||||||
|
mpirun -N 7 ./lmp_cpu -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4096K.7
|
||||||
|
mpirun -N 7 ./lmp_cpu -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8192K.7
|
||||||
|
|
||||||
|
mpirun -N 8 ./lmp_cpu -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2K.8
|
||||||
|
mpirun -N 8 ./lmp_cpu -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4K.8
|
||||||
|
mpirun -N 8 ./lmp_cpu -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8K.8
|
||||||
|
mpirun -N 8 ./lmp_cpu -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.16K.8
|
||||||
|
mpirun -N 8 ./lmp_cpu -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.32K.8
|
||||||
|
mpirun -N 8 ./lmp_cpu -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.64K.8
|
||||||
|
mpirun -N 8 ./lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.128K.8
|
||||||
|
mpirun -N 8 ./lmp_cpu -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.256K.8
|
||||||
|
mpirun -N 8 ./lmp_cpu -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.512K.8
|
||||||
|
mpirun -N 8 ./lmp_cpu -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.1024K.8
|
||||||
|
mpirun -N 8 ./lmp_cpu -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2048K.8
|
||||||
|
mpirun -N 8 ./lmp_cpu -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4096K.8
|
||||||
|
mpirun -N 8 ./lmp_cpu -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8192K.8
|
||||||
|
|
||||||
|
mpirun -N 9 ./lmp_cpu -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2K.9
|
||||||
|
mpirun -N 9 ./lmp_cpu -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4K.9
|
||||||
|
mpirun -N 9 ./lmp_cpu -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8K.9
|
||||||
|
mpirun -N 9 ./lmp_cpu -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.16K.9
|
||||||
|
mpirun -N 9 ./lmp_cpu -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.32K.9
|
||||||
|
mpirun -N 9 ./lmp_cpu -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.64K.9
|
||||||
|
mpirun -N 9 ./lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.128K.9
|
||||||
|
mpirun -N 9 ./lmp_cpu -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.256K.9
|
||||||
|
mpirun -N 9 ./lmp_cpu -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.512K.9
|
||||||
|
mpirun -N 9 ./lmp_cpu -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.1024K.9
|
||||||
|
mpirun -N 9 ./lmp_cpu -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2048K.9
|
||||||
|
mpirun -N 9 ./lmp_cpu -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4096K.9
|
||||||
|
mpirun -N 9 ./lmp_cpu -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8192K.9
|
||||||
|
|
||||||
|
mpirun -N 10 ./lmp_cpu -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2K.10
|
||||||
|
mpirun -N 10 ./lmp_cpu -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4K.10
|
||||||
|
mpirun -N 10 ./lmp_cpu -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8K.10
|
||||||
|
mpirun -N 10 ./lmp_cpu -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.16K.10
|
||||||
|
mpirun -N 10 ./lmp_cpu -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.32K.10
|
||||||
|
mpirun -N 10 ./lmp_cpu -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.64K.10
|
||||||
|
mpirun -N 10 ./lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.128K.10
|
||||||
|
mpirun -N 10 ./lmp_cpu -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.256K.10
|
||||||
|
mpirun -N 10 ./lmp_cpu -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.512K.10
|
||||||
|
mpirun -N 10 ./lmp_cpu -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.1024K.10
|
||||||
|
mpirun -N 10 ./lmp_cpu -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2048K.10
|
||||||
|
mpirun -N 10 ./lmp_cpu -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4096K.10
|
||||||
|
mpirun -N 10 ./lmp_cpu -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8192K.10
|
||||||
|
|
||||||
|
mpirun -N 11 ./lmp_cpu -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2K.11
|
||||||
|
mpirun -N 11 ./lmp_cpu -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4K.11
|
||||||
|
mpirun -N 11 ./lmp_cpu -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8K.11
|
||||||
|
mpirun -N 11 ./lmp_cpu -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.16K.11
|
||||||
|
mpirun -N 11 ./lmp_cpu -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.32K.11
|
||||||
|
mpirun -N 11 ./lmp_cpu -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.64K.11
|
||||||
|
mpirun -N 11 ./lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.128K.11
|
||||||
|
mpirun -N 11 ./lmp_cpu -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.256K.11
|
||||||
|
mpirun -N 11 ./lmp_cpu -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.512K.11
|
||||||
|
mpirun -N 11 ./lmp_cpu -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.1024K.11
|
||||||
|
mpirun -N 11 ./lmp_cpu -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2048K.11
|
||||||
|
mpirun -N 11 ./lmp_cpu -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4096K.11
|
||||||
|
mpirun -N 11 ./lmp_cpu -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8192K.11
|
||||||
|
|
||||||
|
mpirun -N 12 ./lmp_cpu -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2K.12
|
||||||
|
mpirun -N 12 ./lmp_cpu -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4K.12
|
||||||
|
mpirun -N 12 ./lmp_cpu -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8K.12
|
||||||
|
mpirun -N 12 ./lmp_cpu -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.16K.12
|
||||||
|
mpirun -N 12 ./lmp_cpu -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.32K.12
|
||||||
|
mpirun -N 12 ./lmp_cpu -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.64K.12
|
||||||
|
mpirun -N 12 ./lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.128K.12
|
||||||
|
mpirun -N 12 ./lmp_cpu -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.256K.12
|
||||||
|
mpirun -N 12 ./lmp_cpu -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.512K.12
|
||||||
|
mpirun -N 12 ./lmp_cpu -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.1024K.12
|
||||||
|
mpirun -N 12 ./lmp_cpu -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2048K.12
|
||||||
|
mpirun -N 12 ./lmp_cpu -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4096K.12
|
||||||
|
mpirun -N 12 ./lmp_cpu -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8192K.12
|
||||||
|
|
||||||
|
mpirun -N 13 ./lmp_cpu -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2K.13
|
||||||
|
mpirun -N 13 ./lmp_cpu -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4K.13
|
||||||
|
mpirun -N 13 ./lmp_cpu -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8K.13
|
||||||
|
mpirun -N 13 ./lmp_cpu -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.16K.13
|
||||||
|
mpirun -N 13 ./lmp_cpu -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.32K.13
|
||||||
|
mpirun -N 13 ./lmp_cpu -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.64K.13
|
||||||
|
mpirun -N 13 ./lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.128K.13
|
||||||
|
mpirun -N 13 ./lmp_cpu -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.256K.13
|
||||||
|
mpirun -N 13 ./lmp_cpu -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.512K.13
|
||||||
|
mpirun -N 13 ./lmp_cpu -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.1024K.13
|
||||||
|
mpirun -N 13 ./lmp_cpu -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2048K.13
|
||||||
|
mpirun -N 13 ./lmp_cpu -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4096K.13
|
||||||
|
mpirun -N 13 ./lmp_cpu -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8192K.13
|
||||||
|
|
||||||
|
mpirun -N 14 ./lmp_cpu -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2K.14
|
||||||
|
mpirun -N 14 ./lmp_cpu -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4K.14
|
||||||
|
mpirun -N 14 ./lmp_cpu -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8K.14
|
||||||
|
mpirun -N 14 ./lmp_cpu -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.16K.14
|
||||||
|
mpirun -N 14 ./lmp_cpu -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.32K.14
|
||||||
|
mpirun -N 14 ./lmp_cpu -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.64K.14
|
||||||
|
mpirun -N 14 ./lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.128K.14
|
||||||
|
mpirun -N 14 ./lmp_cpu -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.256K.14
|
||||||
|
mpirun -N 14 ./lmp_cpu -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.512K.14
|
||||||
|
mpirun -N 14 ./lmp_cpu -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.1024K.14
|
||||||
|
mpirun -N 14 ./lmp_cpu -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2048K.14
|
||||||
|
mpirun -N 14 ./lmp_cpu -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4096K.14
|
||||||
|
mpirun -N 14 ./lmp_cpu -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8192K.14
|
||||||
|
|
||||||
|
mpirun -N 15 ./lmp_cpu -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2K.15
|
||||||
|
mpirun -N 15 ./lmp_cpu -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4K.15
|
||||||
|
mpirun -N 15 ./lmp_cpu -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8K.15
|
||||||
|
mpirun -N 15 ./lmp_cpu -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.16K.15
|
||||||
|
mpirun -N 15 ./lmp_cpu -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.32K.15
|
||||||
|
mpirun -N 15 ./lmp_cpu -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.64K.15
|
||||||
|
mpirun -N 15 ./lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.128K.15
|
||||||
|
mpirun -N 15 ./lmp_cpu -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.256K.15
|
||||||
|
mpirun -N 15 ./lmp_cpu -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.512K.15
|
||||||
|
mpirun -N 15 ./lmp_cpu -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.1024K.15
|
||||||
|
mpirun -N 15 ./lmp_cpu -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2048K.15
|
||||||
|
mpirun -N 15 ./lmp_cpu -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4096K.15
|
||||||
|
mpirun -N 15 ./lmp_cpu -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8192K.15
|
||||||
|
|
||||||
|
mpirun -N 16 ./lmp_cpu -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2K.16
|
||||||
|
mpirun -N 16 ./lmp_cpu -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4K.16
|
||||||
|
mpirun -N 16 ./lmp_cpu -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8K.16
|
||||||
|
mpirun -N 16 ./lmp_cpu -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.16K.16
|
||||||
|
mpirun -N 16 ./lmp_cpu -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.32K.16
|
||||||
|
mpirun -N 16 ./lmp_cpu -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.64K.16
|
||||||
|
mpirun -N 16 ./lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.128K.16
|
||||||
|
mpirun -N 16 ./lmp_cpu -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.256K.16
|
||||||
|
mpirun -N 16 ./lmp_cpu -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.512K.16
|
||||||
|
mpirun -N 16 ./lmp_cpu -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.1024K.16
|
||||||
|
mpirun -N 16 ./lmp_cpu -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.2048K.16
|
||||||
|
mpirun -N 16 ./lmp_cpu -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.4096K.16
|
||||||
|
mpirun -N 16 ./lmp_cpu -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.cpu.8192K.16
|
||||||
1658
bench/KEPLER/run_gpu.sh
Normal file
1658
bench/KEPLER/run_gpu.sh
Normal file
File diff suppressed because it is too large
Load Diff
83
bench/KEPLER/run_intel_cpu.sh
Normal file
83
bench/KEPLER/run_intel_cpu.sh
Normal file
@ -0,0 +1,83 @@
|
|||||||
|
#!/bin/bash
|
||||||
|
#SBATCH -N 1 --time=12:00:00
|
||||||
|
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 1 -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.single.2K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 1 -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.single.4K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 1 -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.single.8K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 1 -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.single.16K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 1 -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.single.32K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 1 -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.single.64K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 1 -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.single.128K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 1 -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.single.256K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 1 -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.single.512K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 1 -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.single.1024K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 1 -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.single.2048K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 1 -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.single.4096K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 1 -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.single.8192K.16
|
||||||
|
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 3 -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.mixed.2K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 3 -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.mixed.4K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 3 -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.mixed.8K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 3 -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.mixed.16K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 3 -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.mixed.32K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 3 -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.mixed.64K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 3 -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.mixed.128K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 3 -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.mixed.256K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 3 -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.mixed.512K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 3 -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.mixed.1024K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 3 -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.mixed.2048K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 3 -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.mixed.4096K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 3 -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.mixed.8192K.16
|
||||||
|
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 2 -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.double.2K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 2 -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.double.4K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 2 -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.double.8K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 2 -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.double.16K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 2 -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.double.32K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 2 -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.double.64K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 2 -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.double.128K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 2 -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.double.256K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 2 -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.double.512K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 2 -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.double.1024K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 2 -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.double.2048K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 2 -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.double.4096K.16
|
||||||
|
mpirun -np 16 lmp_intel_cpu -sf intel -v a 2 -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.intel.cpu
|
||||||
|
mv log.lammps log.28Jun14.lj.intel.cpu.double.8192K.16
|
||||||
650
bench/KEPLER/run_kokkos_cuda.sh
Normal file
650
bench/KEPLER/run_kokkos_cuda.sh
Normal file
@ -0,0 +1,650 @@
|
|||||||
|
#!/bin/bash
|
||||||
|
#SBATCH -N 1 --time=12:00:00
|
||||||
|
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 1 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.1.1
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 1 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.1.1
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 1 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.1.1
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 1 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.1.1
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 1 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.1.1
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 1 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.1.1
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 1 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.1.1
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 1 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.1.1
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 1 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.1.1
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 1 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.1.1
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 1 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.1.1
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 1 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.1.1
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 1 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.1.1
|
||||||
|
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 2 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.1.2
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 2 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.1.2
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 2 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.1.2
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 2 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.1.2
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 2 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.1.2
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 2 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.1.2
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 2 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.1.2
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 2 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.1.2
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 2 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.1.2
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 2 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.1.2
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 2 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.1.2
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 2 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.1.2
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 2 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.1.2
|
||||||
|
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 3 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.1.3
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 3 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.1.3
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 3 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.1.3
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 3 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.1.3
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 3 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.1.3
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 3 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.1.3
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 3 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.1.3
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 3 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.1.3
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 3 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.1.3
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 3 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.1.3
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 3 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.1.3
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 3 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.1.3
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 3 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.1.3
|
||||||
|
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 4 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.1.4
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 4 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.1.4
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 4 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.1.4
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 4 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.1.4
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 4 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.1.4
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 4 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.1.4
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 4 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.1.4
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 4 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.1.4
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 4 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.1.4
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 4 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.1.4
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 4 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.1.4
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 4 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.1.4
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 4 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.1.4
|
||||||
|
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 5 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.1.5
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 5 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.1.5
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 5 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.1.5
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 5 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.1.5
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 5 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.1.5
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 5 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.1.5
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 5 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.1.5
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 5 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.1.5
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 5 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.1.5
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 5 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.1.5
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 5 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.1.5
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 5 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.1.5
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 5 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.1.5
|
||||||
|
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 6 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.1.6
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 6 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.1.6
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 6 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.1.6
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 6 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.1.6
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 6 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.1.6
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 6 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.1.6
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 6 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.1.6
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 6 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.1.6
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 6 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.1.6
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 6 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.1.6
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 6 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.1.6
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 6 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.1.6
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 6 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.1.6
|
||||||
|
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 7 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.1.7
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 7 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.1.7
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 7 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.1.7
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 7 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.1.7
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 7 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.1.7
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 7 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.1.7
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 7 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.1.7
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 7 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.1.7
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 7 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.1.7
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 7 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.1.7
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 7 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.1.7
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 7 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.1.7
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 7 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.1.7
|
||||||
|
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 8 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.1.8
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 8 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.1.8
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 8 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.1.8
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 8 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.1.8
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 8 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.1.8
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 8 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.1.8
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 8 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.1.8
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 8 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.1.8
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 8 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.1.8
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 8 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.1.8
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 8 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.1.8
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 8 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.1.8
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 8 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.1.8
|
||||||
|
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 9 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.1.9
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 9 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.1.9
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 9 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.1.9
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 9 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.1.9
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 9 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.1.9
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 9 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.1.9
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 9 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.1.9
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 9 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.1.9
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 9 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.1.9
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 9 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.1.9
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 9 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.1.9
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 9 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.1.9
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 9 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.1.9
|
||||||
|
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 10 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.1.10
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 10 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.1.10
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 10 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.1.10
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 10 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.1.10
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 10 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.1.10
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 10 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.1.10
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 10 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.1.10
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 10 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.1.10
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 10 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.1.10
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 10 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.1.10
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 10 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.1.10
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 10 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.1.10
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 10 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.1.10
|
||||||
|
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 11 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.1.11
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 11 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.1.11
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 11 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.1.11
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 11 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.1.11
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 11 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.1.11
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 11 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.1.11
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 11 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.1.11
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 11 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.1.11
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 11 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.1.11
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 11 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.1.11
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 11 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.1.11
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 11 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.1.11
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 11 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.1.11
|
||||||
|
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 12 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.1.12
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 12 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.1.12
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 12 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.1.12
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 12 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.1.12
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 12 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.1.12
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 12 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.1.12
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 12 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.1.12
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 12 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.1.12
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 12 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.1.12
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 12 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.1.12
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 12 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.1.12
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 12 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.1.12
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 12 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.1.12
|
||||||
|
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 13 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.1.13
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 13 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.1.13
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 13 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.1.13
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 13 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.1.13
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 13 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.1.13
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 13 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.1.13
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 13 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.1.13
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 13 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.1.13
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 13 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.1.13
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 13 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.1.13
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 13 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.1.13
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 13 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.1.13
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 13 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.1.13
|
||||||
|
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 14 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.1.14
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 14 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.1.14
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 14 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.1.14
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 14 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.1.14
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 14 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.1.14
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 14 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.1.14
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 14 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.1.14
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 14 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.1.14
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 14 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.1.14
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 14 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.1.14
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 14 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.1.14
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 14 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.1.14
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 14 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.1.14
|
||||||
|
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 15 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.1.15
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 15 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.1.15
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 15 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.1.15
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 15 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.1.15
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 15 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.1.15
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 15 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.1.15
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 15 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.1.15
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 15 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.1.15
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 15 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.1.15
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 15 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.1.15
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 15 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.1.15
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 15 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.1.15
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 15 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.1.15
|
||||||
|
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 16 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.1.16
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 16 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.1.16
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 16 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.1.16
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 16 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.1.16
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 16 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.1.16
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 16 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.1.16
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 16 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.1.16
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 16 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.1.16
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 16 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.1.16
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 16 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.1.16
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 16 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.1.16
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 16 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.1.16
|
||||||
|
mpirun -np 1 ./lmp_kokkos_cuda -k on g 1 t 16 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.1.16
|
||||||
|
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 1 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.2.1
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 1 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.2.1
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 1 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.2.1
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 1 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.2.1
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 1 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.2.1
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 1 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.2.1
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 1 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.2.1
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 1 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.2.1
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 1 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.2.1
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 1 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.2.1
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 1 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.2.1
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 1 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.2.1
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 1 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.2.1
|
||||||
|
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 2 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.2.2
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 2 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.2.2
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 2 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.2.2
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 2 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.2.2
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 2 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.2.2
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 2 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.2.2
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 2 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.2.2
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 2 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.2.2
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 2 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.2.2
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 2 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.2.2
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 2 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.2.2
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 2 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.2.2
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 2 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.2.2
|
||||||
|
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 3 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.2.3
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 3 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.2.3
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 3 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.2.3
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 3 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.2.3
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 3 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.2.3
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 3 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.2.3
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 3 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.2.3
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 3 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.2.3
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 3 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.2.3
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 3 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.2.3
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 3 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.2.3
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 3 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.2.3
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 3 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.2.3
|
||||||
|
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 4 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.2.4
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 4 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.2.4
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 4 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.2.4
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 4 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.2.4
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 4 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.2.4
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 4 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.2.4
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 4 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.2.4
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 4 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.2.4
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 4 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.2.4
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 4 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.2.4
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 4 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.2.4
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 4 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.2.4
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 4 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.2.4
|
||||||
|
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 5 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.2.5
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 5 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.2.5
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 5 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.2.5
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 5 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.2.5
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 5 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.2.5
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 5 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.2.5
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 5 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.2.5
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 5 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.2.5
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 5 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.2.5
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 5 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.2.5
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 5 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.2.5
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 5 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.2.5
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 5 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.2.5
|
||||||
|
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 6 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.2.6
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 6 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.2.6
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 6 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.2.6
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 6 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.2.6
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 6 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.2.6
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 6 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.2.6
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 6 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.2.6
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 6 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.2.6
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 6 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.2.6
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 6 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.2.6
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 6 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.2.6
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 6 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.2.6
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 6 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.2.6
|
||||||
|
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 7 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.2.7
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 7 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.2.7
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 7 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.2.7
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 7 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.2.7
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 7 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.2.7
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 7 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.2.7
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 7 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.2.7
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 7 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.2.7
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 7 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.2.7
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 7 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.2.7
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 7 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.2.7
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 7 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.2.7
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 7 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.2.7
|
||||||
|
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 8 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2K.2.8
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 8 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4K.2.8
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 8 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8K.2.8
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 8 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.16K.2.8
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 8 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.32K.2.8
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 8 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.64K.2.8
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 8 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.128K.2.8
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 8 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.256K.2.8
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 8 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.512K.2.8
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 8 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.1024K.2.8
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 8 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.2048K.2.8
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 8 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.4096K.2.8
|
||||||
|
mpirun -np 2 ./lmp_kokkos_cuda -k on g 2 t 8 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.cuda.8192K.2.8
|
||||||
137
bench/KEPLER/run_kokkos_omp.sh
Normal file
137
bench/KEPLER/run_kokkos_omp.sh
Normal file
@ -0,0 +1,137 @@
|
|||||||
|
#!/bin/bash
|
||||||
|
#SBATCH -N 1 --time=12:00:00
|
||||||
|
|
||||||
|
mpirun -np 1 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.2K.1.8
|
||||||
|
mpirun -np 1 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.4K.1.8
|
||||||
|
mpirun -np 1 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.8K.1.8
|
||||||
|
mpirun -np 1 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.16K.1.8
|
||||||
|
mpirun -np 1 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.32K.1.8
|
||||||
|
mpirun -np 1 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.64K.1.8
|
||||||
|
mpirun -np 1 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.128K.1.8
|
||||||
|
mpirun -np 1 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.256K.1.8
|
||||||
|
mpirun -np 1 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.512K.1.8
|
||||||
|
mpirun -np 1 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.1024K.1.8
|
||||||
|
mpirun -np 1 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.2048K.1.8
|
||||||
|
mpirun -np 1 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.4096K.1.8
|
||||||
|
mpirun -np 1 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.8192K.1.8
|
||||||
|
|
||||||
|
mpirun -np 2 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.2K.2.8
|
||||||
|
mpirun -np 2 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.4K.2.8
|
||||||
|
mpirun -np 2 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.8K.2.8
|
||||||
|
mpirun -np 2 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.16K.2.8
|
||||||
|
mpirun -np 2 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.32K.2.8
|
||||||
|
mpirun -np 2 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.64K.2.8
|
||||||
|
mpirun -np 2 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.128K.2.8
|
||||||
|
mpirun -np 2 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.256K.2.8
|
||||||
|
mpirun -np 2 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.512K.2.8
|
||||||
|
mpirun -np 2 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.1024K.2.8
|
||||||
|
mpirun -np 2 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.2048K.2.8
|
||||||
|
mpirun -np 2 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.4096K.2.8
|
||||||
|
mpirun -np 2 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 8 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.8192K.2.8
|
||||||
|
|
||||||
|
mpirun -np 4 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 4 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.2K.4.4
|
||||||
|
mpirun -np 4 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 4 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.4K.4.4
|
||||||
|
mpirun -np 4 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 4 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.8K.4.4
|
||||||
|
mpirun -np 4 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 4 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.16K.4.4
|
||||||
|
mpirun -np 4 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 4 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.32K.4.4
|
||||||
|
mpirun -np 4 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 4 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.64K.4.4
|
||||||
|
mpirun -np 4 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 4 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.128K.4.4
|
||||||
|
mpirun -np 4 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 4 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.256K.4.4
|
||||||
|
mpirun -np 4 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 4 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.512K.4.4
|
||||||
|
mpirun -np 4 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 4 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.1024K.4.4
|
||||||
|
mpirun -np 4 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 4 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.2048K.4.4
|
||||||
|
mpirun -np 4 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 4 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.4096K.4.4
|
||||||
|
mpirun -np 4 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 4 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.8192K.4.4
|
||||||
|
|
||||||
|
mpirun -np 8 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 2 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.2K.8.2
|
||||||
|
mpirun -np 8 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 2 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.4K.8.2
|
||||||
|
mpirun -np 8 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 2 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.8K.8.2
|
||||||
|
mpirun -np 8 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 2 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.16K.8.2
|
||||||
|
mpirun -np 8 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 2 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.32K.8.2
|
||||||
|
mpirun -np 8 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 2 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.64K.8.2
|
||||||
|
mpirun -np 8 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 2 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.128K.8.2
|
||||||
|
mpirun -np 8 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 2 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.256K.8.2
|
||||||
|
mpirun -np 8 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 2 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.512K.8.2
|
||||||
|
mpirun -np 8 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 2 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.1024K.8.2
|
||||||
|
mpirun -np 8 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 2 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.2048K.8.2
|
||||||
|
mpirun -np 8 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 2 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.4096K.8.2
|
||||||
|
mpirun -np 8 -bind-to socket -map-by socket -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 2 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.8192K.8.2
|
||||||
|
|
||||||
|
mpirun -np 16 -bind-to core -map-by core -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 1 -sf kk -v c device -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.kokkos.omphalf
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.2K.16.1
|
||||||
|
mpirun -np 16 -bind-to core -map-by core -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 1 -sf kk -v c device -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.kokkos.omphalf
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.4K.16.1
|
||||||
|
mpirun -np 16 -bind-to core -map-by core -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 1 -sf kk -v c device -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.omphalf
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.8K.16.1
|
||||||
|
mpirun -np 16 -bind-to core -map-by core -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 1 -sf kk -v c device -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.kokkos.omphalf
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.16K.16.1
|
||||||
|
mpirun -np 16 -bind-to core -map-by core -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 1 -sf kk -v c device -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.kokkos.omphalf
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.32K.16.1
|
||||||
|
mpirun -np 16 -bind-to core -map-by core -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 1 -sf kk -v c device -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.omphalf
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.64K.16.1
|
||||||
|
mpirun -np 16 -bind-to core -map-by core -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 1 -sf kk -v c device -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.kokkos.omphalf
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.128K.16.1
|
||||||
|
mpirun -np 16 -bind-to core -map-by core -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 1 -sf kk -v c device -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.kokkos.omphalf
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.256K.16.1
|
||||||
|
mpirun -np 16 -bind-to core -map-by core -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 1 -sf kk -v c device -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.omphalf
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.512K.16.1
|
||||||
|
mpirun -np 16 -bind-to core -map-by core -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 1 -sf kk -v c device -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.kokkos.omphalf
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.1024K.16.1
|
||||||
|
mpirun -np 16 -bind-to core -map-by core -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 1 -sf kk -v c device -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.kokkos.omphalf
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.2048K.16.1
|
||||||
|
mpirun -np 16 -bind-to core -map-by core -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 1 -sf kk -v c device -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.omphalf
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.4096K.16.1
|
||||||
|
mpirun -np 16 -bind-to core -map-by core -x KMP_AFFINITY=scatter ./lmp_kokkos_omp -k on t 1 -sf kk -v c device -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.kokkos.omphalf
|
||||||
|
mv log.lammps log.28Jun14.lj.kokkos.omp.8192K.16.1
|
||||||
29
bench/KEPLER/run_opt.sh
Normal file
29
bench/KEPLER/run_opt.sh
Normal file
@ -0,0 +1,29 @@
|
|||||||
|
#!/bin/bash
|
||||||
|
#SBATCH -N 1 --time=12:00:00
|
||||||
|
|
||||||
|
mpirun -np 16 lmp_opt -sf opt -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.opt
|
||||||
|
mv log.lammps log.28Jun14.lj.opt.2K.16
|
||||||
|
mpirun -np 16 lmp_opt -sf opt -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.opt
|
||||||
|
mv log.lammps log.28Jun14.lj.opt.4K.16
|
||||||
|
mpirun -np 16 lmp_opt -sf opt -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.opt
|
||||||
|
mv log.lammps log.28Jun14.lj.opt.8K.16
|
||||||
|
mpirun -np 16 lmp_opt -sf opt -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.opt
|
||||||
|
mv log.lammps log.28Jun14.lj.opt.16K.16
|
||||||
|
mpirun -np 16 lmp_opt -sf opt -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.opt
|
||||||
|
mv log.lammps log.28Jun14.lj.opt.32K.16
|
||||||
|
mpirun -np 16 lmp_opt -sf opt -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.opt
|
||||||
|
mv log.lammps log.28Jun14.lj.opt.64K.16
|
||||||
|
mpirun -np 16 lmp_opt -sf opt -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.opt
|
||||||
|
mv log.lammps log.28Jun14.lj.opt.128K.16
|
||||||
|
mpirun -np 16 lmp_opt -sf opt -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.opt
|
||||||
|
mv log.lammps log.28Jun14.lj.opt.256K.16
|
||||||
|
mpirun -np 16 lmp_opt -sf opt -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.opt
|
||||||
|
mv log.lammps log.28Jun14.lj.opt.512K.16
|
||||||
|
mpirun -np 16 lmp_opt -sf opt -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.opt
|
||||||
|
mv log.lammps log.28Jun14.lj.opt.1024K.16
|
||||||
|
mpirun -np 16 lmp_opt -sf opt -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.opt
|
||||||
|
mv log.lammps log.28Jun14.lj.opt.2048K.16
|
||||||
|
mpirun -np 16 lmp_opt -sf opt -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.opt
|
||||||
|
mv log.lammps log.28Jun14.lj.opt.4096K.16
|
||||||
|
mpirun -np 16 lmp_opt -sf opt -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.opt
|
||||||
|
mv log.lammps log.28Jun14.lj.opt.8192K.16
|
||||||
164
bench/KEPLER/run_user_cuda.sh
Normal file
164
bench/KEPLER/run_user_cuda.sh
Normal file
@ -0,0 +1,164 @@
|
|||||||
|
#!/bin/bash
|
||||||
|
#SBATCH -N 1 --time=12:00:00
|
||||||
|
|
||||||
|
mpirun -N 1 ./lmp_cuda_double -c on -sf cuda -v g 1 -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.2K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_double -c on -sf cuda -v g 1 -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.4K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_double -c on -sf cuda -v g 1 -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.8K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_double -c on -sf cuda -v g 1 -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.16K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_double -c on -sf cuda -v g 1 -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.32K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_double -c on -sf cuda -v g 1 -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.64K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_double -c on -sf cuda -v g 1 -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.128K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_double -c on -sf cuda -v g 1 -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.256K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_double -c on -sf cuda -v g 1 -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.512K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_double -c on -sf cuda -v g 1 -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.1024K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_double -c on -sf cuda -v g 1 -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.2048K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_double -c on -sf cuda -v g 1 -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.4096K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_double -c on -sf cuda -v g 1 -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.8192K.1
|
||||||
|
|
||||||
|
mpirun -N 2 ./lmp_cuda_double -c on -sf cuda -v g 2 -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.2K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_double -c on -sf cuda -v g 2 -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.4K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_double -c on -sf cuda -v g 2 -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.8K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_double -c on -sf cuda -v g 2 -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.16K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_double -c on -sf cuda -v g 2 -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.32K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_double -c on -sf cuda -v g 2 -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.64K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_double -c on -sf cuda -v g 2 -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.128K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_double -c on -sf cuda -v g 2 -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.256K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_double -c on -sf cuda -v g 2 -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.512K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_double -c on -sf cuda -v g 2 -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.1024K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_double -c on -sf cuda -v g 2 -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.2048K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_double -c on -sf cuda -v g 2 -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.4096K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_double -c on -sf cuda -v g 2 -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.double.8192K.2
|
||||||
|
|
||||||
|
mpirun -N 1 ./lmp_cuda_mixed -c on -sf cuda -v g 1 -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.2K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_mixed -c on -sf cuda -v g 1 -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.4K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_mixed -c on -sf cuda -v g 1 -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.8K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_mixed -c on -sf cuda -v g 1 -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.16K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_mixed -c on -sf cuda -v g 1 -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.32K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_mixed -c on -sf cuda -v g 1 -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.64K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_mixed -c on -sf cuda -v g 1 -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.128K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_mixed -c on -sf cuda -v g 1 -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.256K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_mixed -c on -sf cuda -v g 1 -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.512K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_mixed -c on -sf cuda -v g 1 -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.1024K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_mixed -c on -sf cuda -v g 1 -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.2048K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_mixed -c on -sf cuda -v g 1 -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.4096K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_mixed -c on -sf cuda -v g 1 -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.8192K.1
|
||||||
|
|
||||||
|
mpirun -N 2 ./lmp_cuda_mixed -c on -sf cuda -v g 2 -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.2K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_mixed -c on -sf cuda -v g 2 -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.4K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_mixed -c on -sf cuda -v g 2 -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.8K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_mixed -c on -sf cuda -v g 2 -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.16K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_mixed -c on -sf cuda -v g 2 -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.32K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_mixed -c on -sf cuda -v g 2 -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.64K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_mixed -c on -sf cuda -v g 2 -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.128K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_mixed -c on -sf cuda -v g 2 -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.256K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_mixed -c on -sf cuda -v g 2 -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.512K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_mixed -c on -sf cuda -v g 2 -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.1024K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_mixed -c on -sf cuda -v g 2 -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.2048K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_mixed -c on -sf cuda -v g 2 -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.4096K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_mixed -c on -sf cuda -v g 2 -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.mixed.8192K.2
|
||||||
|
|
||||||
|
mpirun -N 1 ./lmp_cuda_single -c on -sf cuda -v g 1 -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.2K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_single -c on -sf cuda -v g 1 -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.4K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_single -c on -sf cuda -v g 1 -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.8K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_single -c on -sf cuda -v g 1 -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.16K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_single -c on -sf cuda -v g 1 -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.32K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_single -c on -sf cuda -v g 1 -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.64K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_single -c on -sf cuda -v g 1 -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.128K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_single -c on -sf cuda -v g 1 -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.256K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_single -c on -sf cuda -v g 1 -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.512K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_single -c on -sf cuda -v g 1 -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.1024K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_single -c on -sf cuda -v g 1 -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.2048K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_single -c on -sf cuda -v g 1 -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.4096K.1
|
||||||
|
mpirun -N 1 ./lmp_cuda_single -c on -sf cuda -v g 1 -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.8192K.1
|
||||||
|
|
||||||
|
mpirun -N 2 ./lmp_cuda_single -c on -sf cuda -v g 2 -v x 8 -v y 8 -v z 8 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.2K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_single -c on -sf cuda -v g 2 -v x 8 -v y 8 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.4K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_single -c on -sf cuda -v g 2 -v x 8 -v y 16 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.8K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_single -c on -sf cuda -v g 2 -v x 16 -v y 16 -v z 16 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.16K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_single -c on -sf cuda -v g 2 -v x 16 -v y 16 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.32K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_single -c on -sf cuda -v g 2 -v x 16 -v y 32 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.64K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_single -c on -sf cuda -v g 2 -v x 32 -v y 32 -v z 32 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.128K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_single -c on -sf cuda -v g 2 -v x 32 -v y 32 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.256K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_single -c on -sf cuda -v g 2 -v x 32 -v y 64 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.512K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_single -c on -sf cuda -v g 2 -v x 64 -v y 64 -v z 64 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.1024K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_single -c on -sf cuda -v g 2 -v x 64 -v y 64 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.2048K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_single -c on -sf cuda -v g 2 -v x 64 -v y 128 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.4096K.2
|
||||||
|
mpirun -N 2 ./lmp_cuda_single -c on -sf cuda -v g 2 -v x 128 -v y 128 -v z 128 -v t 100 < in.lj.cuda
|
||||||
|
mv log.lammps log.28Jun14.lj.cuda.single.8192K.2
|
||||||
137
bench/KEPLER/run_user_omp.sh
Normal file
137
bench/KEPLER/run_user_omp.sh
Normal file
@ -0,0 +1,137 @@
|
|||||||
|
#!/bin/bash
|
||||||
|
#SBATCH -N 1 --time=12:00:00
|
||||||
|
|
||||||
|
mpirun -bind-to none -N 1 ./lmp_omp -v x 8 -v y 8 -v z 8 -v t 100 -v h 16 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.2K.1.16
|
||||||
|
mpirun -bind-to none -N 1 ./lmp_omp -v x 8 -v y 8 -v z 16 -v t 100 -v h 16 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.4K.1.16
|
||||||
|
mpirun -bind-to none -N 1 ./lmp_omp -v x 8 -v y 16 -v z 16 -v t 100 -v h 16 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.8K.1.16
|
||||||
|
mpirun -bind-to none -N 1 ./lmp_omp -v x 16 -v y 16 -v z 16 -v t 100 -v h 16 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.16K.1.16
|
||||||
|
mpirun -bind-to none -N 1 ./lmp_omp -v x 16 -v y 16 -v z 32 -v t 100 -v h 16 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.32K.1.16
|
||||||
|
mpirun -bind-to none -N 1 ./lmp_omp -v x 16 -v y 32 -v z 32 -v t 100 -v h 16 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.64K.1.16
|
||||||
|
mpirun -bind-to none -N 1 ./lmp_omp -v x 32 -v y 32 -v z 32 -v t 100 -v h 16 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.128K.1.16
|
||||||
|
mpirun -bind-to none -N 1 ./lmp_omp -v x 32 -v y 32 -v z 64 -v t 100 -v h 16 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.256K.1.16
|
||||||
|
mpirun -bind-to none -N 1 ./lmp_omp -v x 32 -v y 64 -v z 64 -v t 100 -v h 16 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.512K.1.16
|
||||||
|
mpirun -bind-to none -N 1 ./lmp_omp -v x 64 -v y 64 -v z 64 -v t 100 -v h 16 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.1024K.1.16
|
||||||
|
mpirun -bind-to none -N 1 ./lmp_omp -v x 64 -v y 64 -v z 128 -v t 100 -v h 16 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.2048K.1.16
|
||||||
|
mpirun -bind-to none -N 1 ./lmp_omp -v x 64 -v y 128 -v z 128 -v t 100 -v h 16 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.4096K.1.16
|
||||||
|
mpirun -bind-to none -N 1 ./lmp_omp -v x 128 -v y 128 -v z 128 -v t 100 -v h 16 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.8192K.1.16
|
||||||
|
|
||||||
|
mpirun -bind-to socket -N 2 ./lmp_omp -v x 8 -v y 8 -v z 8 -v t 100 -v h 8 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.2K.2.8
|
||||||
|
mpirun -bind-to socket -N 2 ./lmp_omp -v x 8 -v y 8 -v z 16 -v t 100 -v h 8 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.4K.2.8
|
||||||
|
mpirun -bind-to socket -N 2 ./lmp_omp -v x 8 -v y 16 -v z 16 -v t 100 -v h 8 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.8K.2.8
|
||||||
|
mpirun -bind-to socket -N 2 ./lmp_omp -v x 16 -v y 16 -v z 16 -v t 100 -v h 8 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.16K.2.8
|
||||||
|
mpirun -bind-to socket -N 2 ./lmp_omp -v x 16 -v y 16 -v z 32 -v t 100 -v h 8 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.32K.2.8
|
||||||
|
mpirun -bind-to socket -N 2 ./lmp_omp -v x 16 -v y 32 -v z 32 -v t 100 -v h 8 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.64K.2.8
|
||||||
|
mpirun -bind-to socket -N 2 ./lmp_omp -v x 32 -v y 32 -v z 32 -v t 100 -v h 8 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.128K.2.8
|
||||||
|
mpirun -bind-to socket -N 2 ./lmp_omp -v x 32 -v y 32 -v z 64 -v t 100 -v h 8 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.256K.2.8
|
||||||
|
mpirun -bind-to socket -N 2 ./lmp_omp -v x 32 -v y 64 -v z 64 -v t 100 -v h 8 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.512K.2.8
|
||||||
|
mpirun -bind-to socket -N 2 ./lmp_omp -v x 64 -v y 64 -v z 64 -v t 100 -v h 8 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.1024K.2.8
|
||||||
|
mpirun -bind-to socket -N 2 ./lmp_omp -v x 64 -v y 64 -v z 128 -v t 100 -v h 8 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.2048K.2.8
|
||||||
|
mpirun -bind-to socket -N 2 ./lmp_omp -v x 64 -v y 128 -v z 128 -v t 100 -v h 8 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.4096K.2.8
|
||||||
|
mpirun -bind-to socket -N 2 ./lmp_omp -v x 128 -v y 128 -v z 128 -v t 100 -v h 8 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.8192K.2.8
|
||||||
|
|
||||||
|
mpirun -bind-to socket -N 4 ./lmp_omp -v x 8 -v y 8 -v z 8 -v t 100 -v h 4 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.2K.4.4
|
||||||
|
mpirun -bind-to socket -N 4 ./lmp_omp -v x 8 -v y 8 -v z 16 -v t 100 -v h 4 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.4K.4.4
|
||||||
|
mpirun -bind-to socket -N 4 ./lmp_omp -v x 8 -v y 16 -v z 16 -v t 100 -v h 4 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.8K.4.4
|
||||||
|
mpirun -bind-to socket -N 4 ./lmp_omp -v x 16 -v y 16 -v z 16 -v t 100 -v h 4 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.16K.4.4
|
||||||
|
mpirun -bind-to socket -N 4 ./lmp_omp -v x 16 -v y 16 -v z 32 -v t 100 -v h 4 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.32K.4.4
|
||||||
|
mpirun -bind-to socket -N 4 ./lmp_omp -v x 16 -v y 32 -v z 32 -v t 100 -v h 4 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.64K.4.4
|
||||||
|
mpirun -bind-to socket -N 4 ./lmp_omp -v x 32 -v y 32 -v z 32 -v t 100 -v h 4 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.128K.4.4
|
||||||
|
mpirun -bind-to socket -N 4 ./lmp_omp -v x 32 -v y 32 -v z 64 -v t 100 -v h 4 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.256K.4.4
|
||||||
|
mpirun -bind-to socket -N 4 ./lmp_omp -v x 32 -v y 64 -v z 64 -v t 100 -v h 4 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.512K.4.4
|
||||||
|
mpirun -bind-to socket -N 4 ./lmp_omp -v x 64 -v y 64 -v z 64 -v t 100 -v h 4 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.1024K.4.4
|
||||||
|
mpirun -bind-to socket -N 4 ./lmp_omp -v x 64 -v y 64 -v z 128 -v t 100 -v h 4 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.2048K.4.4
|
||||||
|
mpirun -bind-to socket -N 4 ./lmp_omp -v x 64 -v y 128 -v z 128 -v t 100 -v h 4 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.4096K.4.4
|
||||||
|
mpirun -bind-to socket -N 4 ./lmp_omp -v x 128 -v y 128 -v z 128 -v t 100 -v h 4 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.8192K.4.4
|
||||||
|
|
||||||
|
mpirun -bind-to socket -N 8 ./lmp_omp -v x 8 -v y 8 -v z 8 -v t 100 -v h 2 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.2K.8.2
|
||||||
|
mpirun -bind-to socket -N 8 ./lmp_omp -v x 8 -v y 8 -v z 16 -v t 100 -v h 2 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.4K.8.2
|
||||||
|
mpirun -bind-to socket -N 8 ./lmp_omp -v x 8 -v y 16 -v z 16 -v t 100 -v h 2 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.8K.8.2
|
||||||
|
mpirun -bind-to socket -N 8 ./lmp_omp -v x 16 -v y 16 -v z 16 -v t 100 -v h 2 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.16K.8.2
|
||||||
|
mpirun -bind-to socket -N 8 ./lmp_omp -v x 16 -v y 16 -v z 32 -v t 100 -v h 2 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.32K.8.2
|
||||||
|
mpirun -bind-to socket -N 8 ./lmp_omp -v x 16 -v y 32 -v z 32 -v t 100 -v h 2 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.64K.8.2
|
||||||
|
mpirun -bind-to socket -N 8 ./lmp_omp -v x 32 -v y 32 -v z 32 -v t 100 -v h 2 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.128K.8.2
|
||||||
|
mpirun -bind-to socket -N 8 ./lmp_omp -v x 32 -v y 32 -v z 64 -v t 100 -v h 2 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.256K.8.2
|
||||||
|
mpirun -bind-to socket -N 8 ./lmp_omp -v x 32 -v y 64 -v z 64 -v t 100 -v h 2 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.512K.8.2
|
||||||
|
mpirun -bind-to socket -N 8 ./lmp_omp -v x 64 -v y 64 -v z 64 -v t 100 -v h 2 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.1024K.8.2
|
||||||
|
mpirun -bind-to socket -N 8 ./lmp_omp -v x 64 -v y 64 -v z 128 -v t 100 -v h 2 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.2048K.8.2
|
||||||
|
mpirun -bind-to socket -N 8 ./lmp_omp -v x 64 -v y 128 -v z 128 -v t 100 -v h 2 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.4096K.8.2
|
||||||
|
mpirun -bind-to socket -N 8 ./lmp_omp -v x 128 -v y 128 -v z 128 -v t 100 -v h 2 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.8192K.8.2
|
||||||
|
|
||||||
|
mpirun -bind-to core -N 16 ./lmp_omp -v x 8 -v y 8 -v z 8 -v t 100 -v h 1 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.2K.16.1
|
||||||
|
mpirun -bind-to core -N 16 ./lmp_omp -v x 8 -v y 8 -v z 16 -v t 100 -v h 1 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.4K.16.1
|
||||||
|
mpirun -bind-to core -N 16 ./lmp_omp -v x 8 -v y 16 -v z 16 -v t 100 -v h 1 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.8K.16.1
|
||||||
|
mpirun -bind-to core -N 16 ./lmp_omp -v x 16 -v y 16 -v z 16 -v t 100 -v h 1 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.16K.16.1
|
||||||
|
mpirun -bind-to core -N 16 ./lmp_omp -v x 16 -v y 16 -v z 32 -v t 100 -v h 1 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.32K.16.1
|
||||||
|
mpirun -bind-to core -N 16 ./lmp_omp -v x 16 -v y 32 -v z 32 -v t 100 -v h 1 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.64K.16.1
|
||||||
|
mpirun -bind-to core -N 16 ./lmp_omp -v x 32 -v y 32 -v z 32 -v t 100 -v h 1 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.128K.16.1
|
||||||
|
mpirun -bind-to core -N 16 ./lmp_omp -v x 32 -v y 32 -v z 64 -v t 100 -v h 1 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.256K.16.1
|
||||||
|
mpirun -bind-to core -N 16 ./lmp_omp -v x 32 -v y 64 -v z 64 -v t 100 -v h 1 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.512K.16.1
|
||||||
|
mpirun -bind-to core -N 16 ./lmp_omp -v x 64 -v y 64 -v z 64 -v t 100 -v h 1 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.1024K.16.1
|
||||||
|
mpirun -bind-to core -N 16 ./lmp_omp -v x 64 -v y 64 -v z 128 -v t 100 -v h 1 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.2048K.16.1
|
||||||
|
mpirun -bind-to core -N 16 ./lmp_omp -v x 64 -v y 128 -v z 128 -v t 100 -v h 1 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.4096K.16.1
|
||||||
|
mpirun -bind-to core -N 16 ./lmp_omp -v x 128 -v y 128 -v z 128 -v t 100 -v h 1 -sf omp < in.lj.omp
|
||||||
|
mv log.lammps log.28Jun14.lj.omp.8192K.16.1
|
||||||
Reference in New Issue
Block a user