lammps

Files

Christopher Stone 4e8351d9c8 Code clean-up for FixRxKokkos.

- Removed dead code and old errors.
TODO:
  - Per-thread scratch data in kokkos.
  - ODE Diagnostics in kokkos.

2017-02-13 16:33:19 -05:00

angle_charmm_kokkos.cpp

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

angle_charmm_kokkos.h

remove executable permissions on non-executables and non-scripts

2016-09-08 14:45:07 -04:00

angle_harmonic_kokkos.cpp

remove executable permissions on non-executables and non-scripts

2016-09-08 14:45:07 -04:00

angle_harmonic_kokkos.h

remove executable permissions on non-executables and non-scripts

2016-09-08 14:45:07 -04:00

atom_kokkos.cpp

Fixing Kokkos memory deallocation issue

2016-12-16 10:02:01 -07:00

atom_kokkos.h

Adding pair_exp6_rx_kokkos files

2016-11-28 14:25:02 -07:00

atom_vec_angle_kokkos.cpp

Fixing tagint and imageint issues in Kokkos package

2017-02-01 11:52:27 -07:00

atom_vec_angle_kokkos.h

Christian's kokkos patch that allows concurrent host and device threading

2016-03-18 14:50:28 +00:00

atom_vec_atomic_kokkos.cpp

Fixing tagint and imageint issues in Kokkos package

2017-02-01 11:52:27 -07:00

atom_vec_atomic_kokkos.h

Christian's kokkos patch that allows concurrent host and device threading

2016-03-18 14:50:28 +00:00

atom_vec_bond_kokkos.cpp

Fixing tagint and imageint issues in Kokkos package

2017-02-01 11:52:27 -07:00

atom_vec_bond_kokkos.h

Christian's kokkos patch that allows concurrent host and device threading

2016-03-18 14:50:28 +00:00

atom_vec_charge_kokkos.cpp

Fixing tagint and imageint issues in Kokkos package

2017-02-01 11:52:27 -07:00

atom_vec_charge_kokkos.h

Christian's kokkos patch that allows concurrent host and device threading

2016-03-18 14:50:28 +00:00

atom_vec_dpd_kokkos.cpp

Adding missing sync/modified in atom_vec_dpd_kokkos

2017-01-27 10:18:41 -07:00

atom_vec_dpd_kokkos.h

Integrating atom_vec_dpd into the Kokkos package

2016-11-21 13:54:14 -07:00

atom_vec_full_kokkos.cpp

Fixing bug with Kokkos and reading restart files

2016-12-28 10:59:30 -07:00

atom_vec_full_kokkos.h

Christian's kokkos patch that allows concurrent host and device threading

2016-03-18 14:50:28 +00:00

atom_vec_kokkos.cpp

Christian's kokkos patch that allows concurrent host and device threading

2016-03-18 14:50:28 +00:00

atom_vec_kokkos.h

Updating to master

2016-12-12 09:18:20 -07:00

atom_vec_molecular_kokkos.cpp

Fixing tagint and imageint issues in Kokkos package

2017-02-01 11:52:27 -07:00

atom_vec_molecular_kokkos.h

Christian's kokkos patch that allows concurrent host and device threading

2016-03-18 14:50:28 +00:00

bond_fene_kokkos.cpp

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

bond_fene_kokkos.h

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

bond_harmonic_kokkos.cpp

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

bond_harmonic_kokkos.h

remove executable permissions on non-executables and non-scripts

2016-09-08 14:45:07 -04:00

comm_kokkos.cpp

correct small (but harmless) logic error.

2016-08-22 14:34:43 -04:00

comm_kokkos.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14220 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2015-10-30 20:04:06 +00:00

comm_tiled_kokkos.cpp

add missing return in comm_tiled_kokkos

2016-12-28 10:55:51 -07:00

comm_tiled_kokkos.h

change purge target in Makefile, also fixed one issue with Make.py

2016-09-30 09:17:55 -06:00

compute_temp_kokkos.cpp

remove executable permissions on non-executables and non-scripts

2016-09-08 14:45:07 -04:00

compute_temp_kokkos.h

prevent implicit dereference of s_CTEMP

2017-01-03 15:17:33 -07:00

dihedral_charmm_kokkos.cpp

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

dihedral_charmm_kokkos.h

remove executable permissions on non-executables and non-scripts

2016-09-08 14:45:07 -04:00

dihedral_opls_kokkos.cpp

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

dihedral_opls_kokkos.h

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

domain_kokkos.cpp

Fixing tagint and imageint issues in Kokkos package

2017-02-01 11:52:27 -07:00

domain_kokkos.h

draft CUDA-callable version of Domain::unmap

2016-12-21 08:53:57 -07:00

fix_deform_kokkos.cpp

new fix wall/gran/region command, REBO bug fix, new example log files

2016-10-06 15:47:41 -06:00

fix_deform_kokkos.h

remove executable permissions on non-executables and non-scripts

2016-09-08 14:45:07 -04:00

fix_dpd_energy_kokkos.cpp

remove syncs that shouldn't be needed

2017-01-03 11:50:44 -07:00

fix_dpd_energy_kokkos.h

member function containing lambdas must be public

2017-01-03 11:50:44 -07:00

fix_eos_table_rx_kokkos.cpp

Fixing warnings in Kokkos

2017-01-26 09:24:13 -07:00

fix_eos_table_rx_kokkos.h

Updating fix_eos_table_rx_kokkos to USER-DPD changes

2017-01-03 10:09:44 -07:00

fix_langevin_kokkos.cpp

Fixing GPU memory issue in fix_langevin_kokkos

2017-01-25 12:53:55 -07:00

fix_langevin_kokkos.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14220 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2015-10-30 20:04:06 +00:00

fix_momentum_kokkos.cpp

repair sync bugs in fix_momentum_kokkos

2016-12-28 10:51:59 -07:00

fix_momentum_kokkos.h

allow fix momentum angular with CUDA

2016-12-21 08:55:33 -07:00

fix_nh_kokkos.cpp

new fix wall/gran/region command, REBO bug fix, new example log files

2016-10-06 15:47:41 -06:00

fix_nh_kokkos.h

remove executable permissions on non-executables and non-scripts

2016-09-08 14:45:07 -04:00

fix_nph_kokkos.cpp

new fix wall/gran/region command, REBO bug fix, new example log files

2016-10-06 15:47:41 -06:00

fix_nph_kokkos.h

remove executable permissions on non-executables and non-scripts

2016-09-08 14:45:07 -04:00

fix_npt_kokkos.cpp

new fix wall/gran/region command, REBO bug fix, new example log files

2016-10-06 15:47:41 -06:00

fix_npt_kokkos.h

remove executable permissions on non-executables and non-scripts

2016-09-08 14:45:07 -04:00

fix_nve_kokkos.cpp

new fix wall/gran/region command, REBO bug fix, new example log files

2016-10-06 15:47:41 -06:00

fix_nve_kokkos.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14220 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2015-10-30 20:04:06 +00:00

fix_nvt_kokkos.cpp

new fix wall/gran/region command, REBO bug fix, new example log files

2016-10-06 15:47:41 -06:00

fix_nvt_kokkos.h

remove executable permissions on non-executables and non-scripts

2016-09-08 14:45:07 -04:00

fix_property_atom_kokkos.cpp

Fixing runtime issues with pair_exp6_rx_kokkos

2016-12-16 10:06:12 -07:00

fix_property_atom_kokkos.h

Adding Kokkos version of fix_property_atom

2016-12-15 15:50:30 -07:00

fix_qeq_reax_kokkos.cpp

correct issue with compiling for -DLAMMPS_BIGBIG in fix qeq/reax/kk

2017-01-31 18:13:44 -05:00

fix_qeq_reax_kokkos.h

correct issue with compiling for -DLAMMPS_BIGBIG in fix qeq/reax/kk

2017-01-31 18:13:44 -05:00

fix_reaxc_bonds_kokkos.cpp

silence compiler warning about dead code

2017-01-31 18:28:04 -05:00

fix_reaxc_bonds_kokkos.h

Stan bug fixes for fix reaxc/bonds/kk

2016-11-09 15:47:50 -07:00

fix_reaxc_species_kokkos.cpp

added examples/threebody, fix reaxc/speceies/kk

2016-11-04 10:56:04 -06:00

fix_reaxc_species_kokkos.h

new library functions

2016-10-27 09:34:04 -06:00

fix_rx_kokkos.cpp

Code clean-up for FixRxKokkos.

2017-02-13 16:33:19 -05:00

fix_rx_kokkos.h

Fixed errors in FixRxKokkos kokkos neighbor lists initialization and

2017-02-13 16:33:18 -05:00

fix_setforce_kokkos.cpp

new fix wall/gran/region command, REBO bug fix, new example log files

2016-10-06 15:47:41 -06:00

fix_setforce_kokkos.h

silence "implicit dereference" warning

2016-12-28 10:56:06 -07:00

fix_wall_reflect_kokkos.cpp

new fix wall/gran/region command, REBO bug fix, new example log files

2016-10-06 15:47:41 -06:00

fix_wall_reflect_kokkos.h

added examples/threebody, fix reaxc/speceies/kk

2016-11-04 10:56:04 -06:00

gridcomm_kokkos.cpp

add pppm/kk and fix reax/c issues

2016-09-06 10:46:51 -06:00

gridcomm_kokkos.h

add pppm/kk and fix reax/c issues

2016-09-06 10:46:51 -06:00

improper_harmonic_kokkos.cpp

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

improper_harmonic_kokkos.h

remove executable permissions on non-executables and non-scripts

2016-09-08 14:45:07 -04:00

Install.sh

Updated KOKKOS installer and updated USER-DPD FixRx to match KOKKOS version.

2017-02-13 16:33:09 -05:00

kokkos_few.h

allow constructing Few from array on device

2016-12-21 09:21:11 -07:00

kokkos_type.h

put pair_lj_coul in kokkos_type.h

2017-01-12 13:37:53 -07:00

kokkos.cpp

Kokkos neighbor refactor

2016-12-07 13:00:27 -07:00

kokkos.h

Kokkos neighbor refactor

2016-12-07 13:00:27 -07:00

math_special_kokkos.cpp

add pppm/kk and fix reax/c issues

2016-09-06 10:46:51 -06:00

math_special_kokkos.h

fix double-return warning

2017-01-25 15:22:42 -07:00

memory_kokkos.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14220 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2015-10-30 20:04:06 +00:00

modify_kokkos.cpp

Fixing GPU memory issue in modify_kokkos, need to cherry pick back to Master

2017-01-19 12:13:48 -07:00

modify_kokkos.h

pair TIP4P bug fix for cutoffs >> box size

2017-01-06 09:57:27 -07:00

nbin_kokkos.cpp

simplified neighbor list copying to avoid possible same-timestep re-build issues

2017-01-19 17:01:15 -07:00

nbin_kokkos.h

Kokkos neighbor refactor

2016-12-07 13:00:27 -07:00

neigh_bond_kokkos.cpp

remove executable permissions on non-executables and non-scripts

2016-09-08 14:45:07 -04:00

neigh_bond_kokkos.h

remove executable permissions on non-executables and non-scripts

2016-09-08 14:45:07 -04:00

neigh_list_kokkos.cpp

Kokkos neighbor refactor

2016-12-07 13:00:27 -07:00

neigh_list_kokkos.h

it compiles.

2017-01-11 13:18:13 -07:00

neighbor_kokkos.cpp

remove unused variable

2017-01-25 15:38:41 -07:00

neighbor_kokkos.h

Kokkos neighbor refactor

2016-12-07 13:00:27 -07:00

npair_copy_kokkos.cpp

More changes for Kokkos neighbor

2016-12-09 15:56:55 -07:00

npair_copy_kokkos.h

More changes for Kokkos neighbor

2016-12-09 15:56:55 -07:00

npair_kokkos.cpp

Whitespace change to npair_kokkos

2017-01-27 15:17:39 -07:00

npair_kokkos.h

Merge branch 'kokkos_lammps_bigbig_fix' of https://github.com/rbberger/lammps into tagint-issue

2017-01-31 17:23:51 -05:00

pair_buck_coul_cut_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_buck_coul_cut_kokkos.h

Fixing typo in pair_buck_coul_cut_kokkos

2017-02-02 15:21:05 -07:00

pair_buck_coul_long_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_buck_coul_long_kokkos.h

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_buck_kokkos.cpp

Kokkos neighbor refactor

2016-12-07 13:00:27 -07:00

pair_buck_kokkos.h

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_coul_cut_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_coul_cut_kokkos.h

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_coul_debye_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_coul_debye_kokkos.h

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_coul_dsf_kokkos.cpp

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_coul_dsf_kokkos.h

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_coul_long_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_coul_long_kokkos.h

Merge pull request #373 from stanmoore1/kk_more_bugfixes

2017-02-03 14:45:31 -07:00

pair_coul_wolf_kokkos.cpp

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_coul_wolf_kokkos.h

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_dpd_fdt_energy_kokkos.cpp

Fixing warning in pair_dpd_fdt_energy_kokkos

2017-01-26 10:10:52 -07:00

pair_dpd_fdt_energy_kokkos.h

Fixing Kokkos warnings

2017-01-26 10:10:42 -07:00

pair_eam_alloy_kokkos.cpp

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_eam_alloy_kokkos.h

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_eam_fs_kokkos.cpp

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_eam_fs_kokkos.h

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_eam_kokkos.cpp

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_eam_kokkos.h

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_exp6_rx_kokkos.cpp

Removing duplicate code in pair_exp6_rx_kokkos

2017-01-26 10:33:03 -07:00

pair_exp6_rx_kokkos.h

Removing duplicate code in pair_exp6_rx_kokkos

2017-01-26 10:33:03 -07:00

pair_hybrid_kokkos.cpp

Fixing issue with pressure in pair_hybrid_kokkos

2017-01-17 13:28:55 -07:00

pair_hybrid_kokkos.h

Fixing issue with pressure in pair_hybrid_kokkos

2017-01-17 13:28:55 -07:00

pair_hybrid_overlay_kokkos.cpp

Fixing inheritance issue in pair_hybrid_overlay_kokkos

2017-01-13 13:50:21 -07:00

pair_hybrid_overlay_kokkos.h

Fixing inheritance issue in pair_hybrid_overlay_kokkos

2017-01-13 13:50:21 -07:00

pair_kokkos.h

Kokkos neighbor refactor

2016-12-07 13:00:27 -07:00

pair_lj_charmm_coul_charmm_implicit_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_charmm_coul_charmm_implicit_kokkos.h

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_charmm_coul_charmm_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_charmm_coul_charmm_kokkos.h

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_charmm_coul_long_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_charmm_coul_long_kokkos.h

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_class2_coul_cut_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_class2_coul_cut_kokkos.h

Adding missing friend statement to pair_lj_class2_coul_cut_kokkos

2017-02-02 15:21:30 -07:00

pair_lj_class2_coul_long_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_class2_coul_long_kokkos.h

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_class2_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_class2_kokkos.h

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_cut_coul_cut_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_cut_coul_cut_kokkos.h

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_lj_cut_coul_debye_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_cut_coul_debye_kokkos.h

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_lj_cut_coul_dsf_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_cut_coul_dsf_kokkos.h

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_lj_cut_coul_long_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_cut_coul_long_kokkos.h

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_cut_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_cut_kokkos.h

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_expand_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_expand_kokkos.h

Add missing typedef in Kokkos pair styles

2017-02-02 13:24:05 -07:00

pair_lj_gromacs_coul_gromacs_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_gromacs_coul_gromacs_kokkos.h

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_gromacs_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_gromacs_kokkos.h

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_sdk_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_lj_sdk_kokkos.h

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_morse_kokkos.cpp

Updated contributing authors and docs

2017-02-02 13:42:47 +01:00

pair_morse_kokkos.h

Updated contributing authors and docs

2017-02-02 13:42:47 +01:00

pair_multi_lucy_rx_kokkos.cpp

Fixing Kokkos warnings

2017-01-26 10:10:42 -07:00

pair_multi_lucy_rx_kokkos.h

Updating pair_multi_lucy_rx_kokkos to USER-DPD changes

2017-01-03 11:51:28 -07:00

pair_reax_c_kokkos.cpp

Fixing tagint and imageint issues in Kokkos package

2017-02-01 11:52:27 -07:00

pair_reax_c_kokkos.h

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_sw_kokkos.cpp

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_sw_kokkos.h

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_table_kokkos.cpp

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_table_kokkos.h

Fixing Kokkos per-atom e/v issue

2017-02-02 13:09:52 -07:00

pair_table_rx_kokkos.cpp

fix CUDA type issues in pair_table_rx_kokkos

2017-01-13 14:40:36 -07:00

pair_table_rx_kokkos.h

fix CUDA type issues in pair_table_rx_kokkos

2017-01-13 14:40:36 -07:00

pair_tersoff_kokkos.cpp

Merge pull request #373 from stanmoore1/kk_more_bugfixes

2017-02-03 14:45:31 -07:00

pair_tersoff_kokkos.h

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_tersoff_mod_kokkos.cpp

fix typo

2017-02-08 14:33:45 -05:00

pair_tersoff_mod_kokkos.h

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_tersoff_zbl_kokkos.cpp

Merge pull request #373 from stanmoore1/kk_more_bugfixes

2017-02-03 14:45:31 -07:00

pair_tersoff_zbl_kokkos.h

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pair_vashishta_kokkos.cpp

Merge branch 'master' into USER-DPD_kokkos

2017-02-06 15:45:26 -05:00

pair_vashishta_kokkos.h

Fixing more Kokkos per-atom and fdotr issues

2017-02-02 15:21:21 -07:00

pppm_kokkos.cpp

Merge pull request #362 from ibaned/warnings2

2017-02-03 14:43:12 -07:00

pppm_kokkos.h

add pppm/kk and fix reax/c issues

2016-09-06 10:46:51 -06:00

rand_pool_wrap_kokkos.cpp

Renaming rand_pool_wrap to rand_pool_wrap_kokkos

2016-12-19 16:50:22 -07:00

rand_pool_wrap_kokkos.h

Fixing warnings in Kokkos

2017-01-26 09:24:13 -07:00

README

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12897 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2015-01-08 18:16:47 +00:00

region_block_kokkos.cpp

rename region_block_kokkos inside()

2016-12-28 10:56:16 -07:00

region_block_kokkos.h

rename region_block_kokkos inside()

2016-12-28 10:56:16 -07:00

verlet_kokkos.cpp

Fixing GPU memory issues in Kokkos

2017-01-19 12:14:25 -07:00

verlet_kokkos.h

Christian's kokkos patch that allows concurrent host and device threading

2016-03-18 14:50:28 +00:00

README

This package implements optimizations of various LAMMPS styles using
the Kokkos library, which is part of Trilinos
(http://trilinos.sandia.gov/packages/kokkos).  It's a templated C++
library that provides two key abstractions for an application like
LAMMPS.  First, it allows a single implementation of an application
kernel (e.g. a pair style) to run efficiently on different kinds of
hardware, such as a GPU, Intel Phi, or many-core chip.

This package uses an external library in lib/kokkos.  However the
"library" is mostly header files and is auto-built when building
LAMMPS with this package installed, so no special pre-build of the
library is necessary.  See the lib/kokkos/README file and the LAMMPS
manual for information on building LAMMPS with external libraries.
The settings in the Makefile.lammps file in that directory must be
correct for LAMMPS to build correctly with this package installed.

This package was developed primaritly by Christian Trott (Sandia) with
contributions of various styles by others, including Sikandar Mashayak
(UIUC).  The underlying Kokkos library was written primarily by Carter
Edwards, Christian Trott, and Dan Sunderland (all Sandia).