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d2b3677d6f
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whitespace fixes
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2021-02-08 21:45:58 -05:00 |
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33939a0e26
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Merge branch 'master' into thermo-energy
# Conflicts:
# doc/src/fix_ti_spring.rst
# src/RIGID/fix_rigid_small.cpp
# src/fix_langevin.cpp
# src/fix_temp_berendsen.cpp
# src/fix_temp_csld.cpp
# src/fix_temp_csvr.cpp
# src/fix_temp_rescale.cpp
# src/thermo.cpp
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2021-02-08 15:24:29 -05:00 |
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a3a84c4493
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Merge pull request #2584 from jrgissing/bond-react_create_atoms
Bond/react: create atoms
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2021-02-08 10:44:36 -05:00 |
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9995bef911
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file permissions
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2021-02-05 17:50:23 -05:00 |
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0f07215a2b
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add utils::strdup() convenience function
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2021-02-04 17:00:02 -05:00 |
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e5ead83c8f
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near->overlap keyword update
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2021-02-04 15:33:45 -05:00 |
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1e8d57c207
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Merge pull request #120 from lammps/master
rebase
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2021-02-04 13:02:09 -07:00 |
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2bc2140ed9
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Merge branch 'master' of https://github.com/lammps/lammps into lammps-master
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2021-02-04 14:58:52 -05:00 |
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49ea762300
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Merge pull request #2571 from akohlmey/arg-info-class
Add ArgInfo class for simpler processing of compute, fix, and variable references
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2021-02-04 14:32:34 -05:00 |
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de5ba601f2
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Update fix_bond_react.rst
manual rebase
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2021-02-04 13:41:58 -05:00 |
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8574a417fb
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Merge pull request #2579 from lammps/fix-ti-spring-doc
Clarify one of the outputs of fix ti/spring
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2021-02-04 05:50:35 -05:00 |
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04a46bfd99
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Merge remote-tracking branch 'github/master' into arg-info-class
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2021-02-03 17:43:49 -05:00 |
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1ee27e2bc2
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clarify one of the outputs of fix ti/spring
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2021-02-03 15:01:35 -07:00 |
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85539765d0
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update docs about thermo_modify flush
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2021-02-02 11:37:08 -05:00 |
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c2c8c5e493
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Merge remote-tracking branch 'github/master' into arg-info-class
# Conflicts:
# src/compute_chunk_atom.cpp
# src/compute_chunk_spread_atom.cpp
# src/compute_reduce.cpp
# src/compute_reduce_region.cpp
# src/compute_slice.cpp
# src/fix_ave_atom.cpp
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2021-02-02 11:33:01 -05:00 |
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a83fe46860
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spelling target needs conf.py
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2021-02-01 20:32:19 -05:00 |
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2b44d67128
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consistent dependencies for targes in "doc" folder makefile
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2021-02-01 18:13:00 -05:00 |
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26ea789834
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add some documentation for the programmer guide and doxygen decorations
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2021-01-31 23:06:59 -05:00 |
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829e5a7f85
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update docs about the organization of sources and relation between classes
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2021-01-31 21:06:35 -05:00 |
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f0e4f90608
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reformat paragraph
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2021-01-31 13:06:10 -05:00 |
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aeaaeed703
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clarify and fix typo
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2021-01-30 06:08:35 -05:00 |
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3ce92db405
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correct path to CMake preset folder in example command
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2021-01-30 06:08:17 -05:00 |
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222d842b45
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Merge pull request #2435 from sramirezh/adding_new_pair
Adding new Wang-Frenkel potential pair style
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2021-01-29 16:22:39 -05:00 |
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759ac0ddd9
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Merge pull request #2564 from akohlmey/detect-utf8-multibytes
Detect UTF-8 multibyte characters input and replace with ASCII equivalents where known
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2021-01-29 13:02:34 -05:00 |
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740ae28e3d
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address spelling issues
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2021-01-28 03:59:30 -05:00 |
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9c630d9906
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scale down image
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2021-01-28 03:59:19 -05:00 |
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e3cc058c74
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reformat to have shorter lines
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2021-01-28 03:43:56 -05:00 |
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46984f69ee
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Added the potential comparison with LJ
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2021-01-27 21:39:52 -05:00 |
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0f31cfc554
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corrected the documentation
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2021-01-27 21:21:23 -05:00 |
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4925243d7e
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corrected mistake with the link
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2021-01-28 00:36:42 +00:00 |
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6ba9ebe9b8
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added the pair to pairs style doc
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2021-01-28 00:36:42 +00:00 |
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d295ab9296
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Added the pair documentation
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2021-01-28 00:36:42 +00:00 |
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1f6539934c
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added the pair to the commands
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2021-01-28 00:36:42 +00:00 |
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e67977377b
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Added the documentation
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2021-01-28 00:36:42 +00:00 |
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bca3164fc4
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fix whitespace issues
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2021-01-26 18:39:02 -05:00 |
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80bac27184
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extra files that were not checked in
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2021-01-26 11:02:27 -07:00 |
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78b46e819b
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added Developer doc info for this refactoring
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2021-01-26 10:54:02 -07:00 |
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eb9e28e665
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fix some typos
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2021-01-26 09:30:28 -07:00 |
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fc0936c778
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doc pages for virial contributions of fixes
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2021-01-26 09:26:31 -07:00 |
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6147b9c2ef
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doc page updates for energy contributions of thermostat and non-thermostat fixes
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2021-01-26 08:51:47 -07:00 |
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afc58659db
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add not input parsing section about handling of UFT-8 characters
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2021-01-25 21:44:02 -05:00 |
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1f6cc25176
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Fix link
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2021-01-25 14:04:26 -07:00 |
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0f2d0c539d
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Update Kokkos arch list
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2021-01-25 13:52:35 -07:00 |
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f83b796c83
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Add note on C++14 requirement in Docs
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2021-01-25 13:44:07 -07:00 |
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72168d6780
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add utility functions to detect UTF-8 characters and substitute with ASCII equivalents
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2021-01-25 01:41:38 -05:00 |
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7b87f45d1a
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Merge pull request #2554 from akohlmey/accelerator-introspection
Add accelerator introspection functionality
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2021-01-18 11:59:00 -05:00 |
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7c3cd30ef7
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replace non-ASCII character with ASCII equivalent
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2021-01-16 01:22:38 -05:00 |
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efda7559c0
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Merge branch 'master' into accelerator-introspection
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2021-01-16 00:15:07 -05:00 |
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5e6411ea5a
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Merge pull request #2514 from oywg11/tersoff-shift
Add a shift option to most Tersoff potential variants
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2021-01-15 13:59:56 -05:00 |
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6d1babfe89
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correct reference for eam/he publication
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2021-01-15 11:59:21 -05:00 |
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