4d34e55072
rename jpeg file, recreate tex file and fix typo in docs for dihedral style table/cut
2018-05-11 17:31:14 -04:00
4820cef5d4
cmake: USER-INTEL fix flags
2018-05-11 15:19:29 -06:00
e7598eeec0
ignore new style sources in USER-MSIC
2018-05-11 16:17:00 -04:00
a5d29fa52e
Merge remote-tracking branch 'origin/master' into cmake_intel
2018-05-11 14:13:30 -06:00
821ef0cf77
update documentation for dihedral style table/cut
2018-05-11 16:08:23 -04:00
42f22a9723
Merge pull request #908 from akohlmey/coverity-scan-fixes
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Correct small bugs found by static code analysis
2018-05-11 14:06:18 -06:00
0d8110bc19
Merge pull request #903 from akohlmey/move-enums-to-headers
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Move enums that have to be consistent across files into a class
2018-05-11 14:05:58 -06:00
44c5e88e24
Merge pull request #902 from junghans/cmake
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CMake improvements
2018-05-11 14:05:26 -06:00
8d24101df4
patch 11May18
2018-05-11 14:04:49 -06:00
308dac6821
fix force->bounds() bug and remove dead code
2018-05-11 15:54:51 -04:00
944dab1351
USER-INTEL: enforce icc and add icc flags
2018-05-11 11:53:34 -06:00
c3cc07bd3d
truncate filename path to a segment starting with 'src/'
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this will trim warnings and error messages when compiling using the CMake
build system, which uses full paths. as a bonus,one can now see, if a
source is taken from a package or not.
2018-05-11 13:52:34 -04:00
c50258e89c
cmake: ENABLE -> PKG for packages
2018-05-11 07:51:59 -06:00
9674512997
new dihedral table/cut command
2018-05-11 07:36:40 -06:00
f864584bce
correct small bugs found by coverity scan static code analysis
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- in fix rigid, rigid/small, and poems, a string argument was
incorrectly assigned to a %d format
- plug two small memory leaks in fix bond/react
2018-05-11 00:43:09 -04:00
075598b405
port dump_modify maxfiles option to COMPRESS and MPIIO package
2018-05-10 23:44:27 -04:00
7780d92823
implement 'dump_modify maxfiles' feature as discussed
2018-05-10 23:25:26 -04:00
66caf1c1a3
cmake: rename PNG,JPEG options to WITH_*
2018-05-10 20:33:18 -06:00
95eb86d6c7
Need to use MPI_CXX_INCLUDE_PATH instead of MPI_C_INCLUDE_PATH on Fedora 28 with cmake 3.11
2018-05-10 21:20:06 -04:00
724ade0af3
silence compiler warnings about bool vs int in AtC lib
2018-05-10 18:48:47 -04:00
d43c556263
cmake: fix typo and added summary for KSPACE package
2018-05-10 16:11:10 -06:00
40a8b1af79
fix stupid bug in AtC when using alloca() instead of VLAs
2018-05-10 17:42:10 -04:00
33a41a4fb3
Merge pull request #906 from akohlmey/recover-jenkins
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Recover jenkins test builds
2018-05-10 15:20:01 -06:00
d7992f324d
cmake: summary, fix typo, more info
2018-05-10 14:30:45 -06:00
79d1d3458e
revive lib/atc/Makefile.mpic++
2018-05-10 15:44:36 -04:00
a25895d31d
cmake: add FFT_SINGLE option
2018-05-10 12:52:04 -06:00
4f762deff8
cmake: drop FFTW2 support
2018-05-10 12:37:11 -06:00
843f89fc92
cmake: add GPU into to summary
2018-05-10 12:36:09 -06:00
6336c3b975
cmake: add option to download voro
2018-05-10 12:31:55 -06:00
a43e74180a
cmake: add downlad option for LATTE
2018-05-10 11:09:15 -06:00
6626cd5aaa
cmake: add Eigen3 download for USER-SMD
2018-05-10 11:04:56 -06:00
aa1d815fe5
Merge pull request #904 from jrgissing/typing_bugfix
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Retyping parameters bugfix
2018-05-10 06:56:50 -06:00
863a85353a
type reassignment bugfix for edge atoms
2018-05-09 23:55:04 -06:00
662535865f
Merge pull request #12 from lammps/master
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rebase
2018-05-09 23:51:57 -06:00
6226ec8831
import enum{GEOMETRIC,ARITHMETIC,SIXTHPOWER} from pair.h
2018-05-10 01:32:57 -04:00
6c91cc1f76
cmake: rename ENABLE_MPI to BUILD_MPI
2018-05-09 23:12:00 -06:00
4e42ee2cfc
cmake: add BUILD_OMP option
2018-05-09 23:09:23 -06:00
1224296365
move enum{INT,DOUBLE,STRING,BIGINT}; to Dump class in dump.h
2018-05-10 01:09:04 -04:00
25cef528c9
cmake: remove -fno-second-underscore injection
2018-05-09 23:03:22 -06:00
6359392834
cmake: MEAM needs a C compiler
2018-05-09 23:02:00 -06:00
71e1867dd2
move enum{LAYOUT_UNIFORM,LAYOUT_NONUNIFORM,LAYOUT_TILED}; to Comm class
2018-05-10 00:50:20 -04:00
f90af1839e
cmake: add a warning for QMMM
2018-05-09 22:42:33 -06:00
2ebd4eb26e
cmake: COMPRESS needs zlib
2018-05-09 22:24:22 -06:00
3682bc47c2
move enum{NO_REMAP,X_REMAP,V_REMAP} to Domain class in domain.h
2018-05-10 00:20:10 -04:00
2797afbf3e
cmake: only enable CXX by default
2018-05-09 22:16:19 -06:00
635383c00c
cmake: cache check for installed packages
2018-05-09 22:09:19 -06:00
b6a8168e3f
fix bug in procmap Comm::MULTIPLE import
2018-05-10 00:02:12 -04:00
71fce2e413
move enum{SINGLE,MULTI} and enum{MULTIPLE} to Comm in comm.h
2018-05-09 23:57:24 -04:00
994fd2af0e
move enum{NSQ,BIN,MULTI} to the Neighbor class in neighbor.h
2018-05-09 23:46:09 -04:00
d8138a5b4c
move enum{IGNORE,WARN,ERROR) into Thermo class and use Thermo:: namespace to reference it
2018-05-09 18:11:31 -04:00
