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0a84106b23
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fix whitespace issues
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2020-01-13 22:47:06 -05:00 |
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bd5a97e07e
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add false positives
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2020-01-13 22:41:08 -05:00 |
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8258d0cb59
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remove obsolete .txt file
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2020-01-13 22:28:02 -05:00 |
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231b4b1dce
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Merge branch 'master' into deposit-add
# Conflicts:
# doc/src/fix_deposit.rst
# doc/txt/fix_deposit.txt
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2020-01-13 22:26:26 -05:00 |
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c8f6866f0d
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fixed minor bug in memory allocation for coefficients
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2020-01-13 23:01:20 +00:00 |
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2b51938a94
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changed potential file format to single file
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2020-01-13 22:52:52 +00:00 |
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d3348371e1
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refactoring of code and doc files
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2020-01-13 15:22:02 -07:00 |
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aa70f8cc6b
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small edits for reformatting
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2020-01-13 14:26:22 -07:00 |
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51efee43be
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sync to master
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2020-01-13 13:42:05 -07:00 |
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9ed987c255
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minor changes to syntax and documentation of fix deposit orient
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2020-01-13 13:15:17 -07:00 |
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afcc1d935d
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added and corrected error and warning messages
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2020-01-13 17:45:38 +00:00 |
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e8d11931ec
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merged in current master
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2020-01-13 10:34:31 -07:00 |
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2d28e9fa2e
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check for FFT_FFTW_THREADS may only run when CUDA is not enabled
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2020-01-13 12:08:46 -05:00 |
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03a7f617eb
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now opening files with lmp method
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2020-01-13 17:05:31 +00:00 |
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99dc283f82
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Merge branch 'master' into message-iterate
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2020-01-13 09:30:51 -07:00 |
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e35f160e9c
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added standard potential files to git repo
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2020-01-13 16:23:07 +00:00 |
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206aa77532
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fix one more whitespace issue
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2020-01-13 11:22:42 -05:00 |
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5198058691
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fix whitespace issues in fft3d_kokkos files
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2020-01-13 11:21:44 -05:00 |
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a7720124db
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check and adjust FFT selection for KOKKOS depending on whether CUDA is enabled or not
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2020-01-13 11:09:37 -05:00 |
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88448ef950
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update rst docs since .txt file is gone
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2020-01-13 10:57:36 -05:00 |
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2834965e98
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Merge branch 'master' into fft
# Conflicts:
# doc/txt/kspace_style.txt
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2020-01-13 10:53:26 -05:00 |
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6813ab4c9c
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Merge pull request #1832 from akohlmey/doc-styles-check
Check style command lists against existing styles in sources
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2020-01-13 10:38:26 -05:00 |
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eed85bb676
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Merge pull request #1834 from akohlmey/suffix-flag-refactor
Small Suffix flag refactoring and disallow per substyle special overrides for USER-INTEL and GPU
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2020-01-13 10:37:35 -05:00 |
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8e08acd5d4
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moved mesocnt to user packages
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2020-01-13 15:01:03 +00:00 |
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9d207e5829
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renamed mesocnt directory
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2020-01-13 15:00:42 +00:00 |
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b18f79abe0
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merged latest stable version into fork
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2020-01-13 14:31:18 +00:00 |
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fe1f7f9a9c
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restored Makefile.g++_openmpi to default
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2020-01-13 13:00:31 +00:00 |
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601658fa50
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removed unnecessary headers and converted ints for tag and mol to tagint
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2020-01-13 12:56:30 +00:00 |
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bfaea66e66
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update documentation
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2020-01-12 23:03:45 -05:00 |
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15603e0ff7
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add documentation for including cufft with KOKKOS+CUDA (for conventional build, CMake is automatic)
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2020-01-12 21:46:02 -05:00 |
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3784df23f0
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use FFT_FFTW_THREADS consistently, add CUFFT to CMake, minor improvements
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2020-01-12 21:32:07 -05:00 |
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7cb36d1705
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Merge branch 'master' into fft
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2020-01-12 20:22:15 -05:00 |
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a88e6494cf
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address documentation spelling issues and remove obsolete file
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2020-01-12 15:11:45 -05:00 |
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22af416c53
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correct output to be consistent with other code in LAMMPS
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2020-01-12 14:47:15 -05:00 |
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ebdc4b1ce3
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rework npt/cauchy example to use bundled potential, run shorter and move to proper folder
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2020-01-12 14:46:55 -05:00 |
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0d6ec02d5a
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small corrections and more cleanup
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2020-01-12 14:31:05 -05:00 |
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57f4b06db5
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integrate RST version of npt/cauchy documentation
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2020-01-12 14:06:12 -05:00 |
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107c5bbced
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Merge branch 'master' into cauchystat and resolve conflicts
# Conflicts:
# cmake/CMakeLists.txt
# doc/src/Commands_fix.txt
# doc/src/Packages_details.txt
# doc/src/Packages_user.txt
# doc/src/fix_nh.txt
# doc/src/fixes.txt
# doc/src/lammps.book
# src/Makefile
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2020-01-12 13:58:41 -05:00 |
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2231feaf9b
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some corrections to the documentation
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2020-01-12 13:55:39 -05:00 |
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b6d86e3c91
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merge fix sources and move into USER-MISC package. clean up docs
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2020-01-12 13:45:22 -05:00 |
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ef4e061cb7
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merge contents of fix_npt_cauchy files into fix_cauchy
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2020-01-12 13:27:40 -05:00 |
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755620acb7
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correct documentation link
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2020-01-12 13:10:37 -05:00 |
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7cdd39b894
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remove references to fix npt/cauchy which has its own doc file now
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2020-01-12 13:10:26 -05:00 |
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9811a85a9a
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reformat
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2020-01-12 13:09:53 -05:00 |
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64e72b1cd5
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indent consistently with tabs only
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2020-01-12 12:34:54 -05:00 |
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4a5511d00a
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Merge branch 'collected-small-changes' into doc-styles-check
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2020-01-12 10:19:22 -05:00 |
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81c9b0b12e
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small update to kspace overview
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2020-01-12 10:17:56 -05:00 |
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7b9abda6c4
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refactor to use a function to process files with lists of styles
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2020-01-12 10:17:14 -05:00 |
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c93ee1045c
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Merge branch 'collected-small-changes' into doc-styles-check
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2020-01-12 10:13:34 -05:00 |
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a0ecf539f6
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clean up and correct some documentation link issues
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2020-01-12 10:08:14 -05:00 |
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