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eed7113506
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tests for fene, fene/expand
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2020-08-04 01:57:23 -04:00 |
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6576c4cbf3
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Merge pull request #2260 from akohlmey/collected-small-changes
Collected small changes
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2020-08-03 18:02:17 -04:00 |
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ca7039aa96
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Merge pull request #2271 from abhiShandy/pair-tests-Aug3
Unit tests for born/coul, ufm, yukawa, soft
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2020-08-03 17:23:22 -04:00 |
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436951fb34
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Merge pull request #2270 from akohlmey/check-test-coverage
Add utility to check for missing force style tests
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2020-08-03 16:47:49 -04:00 |
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865e853a41
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Refactor check_tests.py
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2020-08-03 10:37:45 -04:00 |
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f3d7f0be2d
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update test reference data for pair style ufm
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2020-08-03 08:01:37 -04:00 |
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86c6efc04c
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sort list of missing styles alphabetically
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2020-08-03 07:30:15 -04:00 |
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bb183345bb
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remove obsolete function
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2020-08-03 07:29:53 -04:00 |
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10c0b8d90e
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passing test for soft
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2020-08-03 06:23:23 -04:00 |
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80ceff55d5
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failing test for UFM, with cosmetic change in its CPP, and doc correction
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2020-08-03 06:01:59 -04:00 |
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8eb84229bd
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passing tests for born-coul, gauss and yukawa
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2020-08-03 05:59:44 -04:00 |
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90028a3c71
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properly handle hybrid styles when checking for missing tests
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2020-08-03 00:43:41 -04:00 |
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896a08883b
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add a custom python script to check the completeness of tests inputs
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2020-08-03 00:12:51 -04:00 |
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bbb4c39692
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Merge branch 'wip-tests' into force-tests
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2020-08-01 14:53:10 -04:00 |
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eb91c6feb6
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correct data file output format for ZBL style. update reference output.
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2020-08-01 14:43:14 -04:00 |
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cc87557fa7
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tweak parameters for lj/expand to stabilize test run
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2020-08-01 14:24:50 -04:00 |
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6827eb80a8
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fix missing initialization bug in lj/cut/coul/wolf and update reference data
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2020-08-01 14:18:40 -04:00 |
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a4db52c30f
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tweak potential parameters for better stability of test run
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2020-08-01 14:05:27 -04:00 |
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34279840fc
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unit tests for few buck/coul and born/coul; remove mixing from buck
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2020-08-01 08:52:07 -04:00 |
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d15db7b5a7
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fix the atomic numbers in ZBL test
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2020-08-01 07:49:06 -04:00 |
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86c53cb211
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unit tests for few LJ derivatives and ZBL
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2020-08-01 07:39:33 -04:00 |
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2a487f5f47
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unit tests for beck, morse, and few LJ derivatives
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2020-08-01 07:27:39 -04:00 |
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74f50ed1bd
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Merge branch 'master' into collected-small-changes
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2020-07-31 21:51:10 -04:00 |
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59b5c7c154
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Merge pull request #2264 from akohlmey/fix_ttm_parser_update
Refactor parsing of input files in fix ttm and fix ttm/mod
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2020-07-31 18:14:54 -04:00 |
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067540fef1
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diversify exponents in mie/cut test
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2020-07-31 12:11:24 -04:00 |
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1017b76c71
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reformat pair_coeff section in buck test for better readability
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2020-07-31 12:08:00 -04:00 |
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12924346ac
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unit tests for born, buck, lj96 and mie cut
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2020-07-31 11:46:51 -04:00 |
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814e2e9aaf
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turn off optimization for Clang compilers when compiling atom style tester
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2020-07-30 23:41:24 -04:00 |
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4b91ab0d23
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add utils::trim() function to remove leading and trailing whitespace from string
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2020-07-30 23:39:37 -04:00 |
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f0e6651780
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Merge branch 'first-test' of github.com:abhiShandy/lammps into collected-small-changes
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2020-07-30 11:46:06 -04:00 |
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facb2f3c27
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fix error in determining A/B parameters. outputs now match lj/mdf as expected.
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2020-07-30 11:44:37 -04:00 |
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36f4e6789a
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simple test for pair-born
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2020-07-30 03:30:57 -04:00 |
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8c849c0104
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add test file for pair style lennard/mdf
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2020-07-29 16:41:11 -04:00 |
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780fb5b376
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add test function to validate updated topology data after reset_atom_ids
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2020-07-27 10:43:37 -04:00 |
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68df62b869
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support verbose option
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2020-07-20 20:40:20 -04:00 |
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5b4275002c
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Merge branch 'master' into kim_fix
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2020-07-20 20:27:41 -04:00 |
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1f819ca333
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update the kim_param command test
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2020-07-19 18:35:20 -05:00 |
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3390e1d4c5
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starting of the kim_property command test
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2020-07-19 18:10:00 -05:00 |
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674514f822
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update the kim_param command test
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2020-07-19 10:35:00 -05:00 |
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262ce37eed
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silence compiler warning
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2020-07-19 07:19:44 -04:00 |
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82f5bbf859
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update the kim_interactions command test
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2020-07-18 20:31:36 -05:00 |
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894a7e4bce
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update test
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2020-07-18 21:10:22 -04:00 |
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bc47ec5027
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update the kim_init command test
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2020-07-18 17:23:24 -05:00 |
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859da19869
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consistently skip death tests at runtime when using OpenMPI without exceptions
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2020-07-18 13:09:17 -04:00 |
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e0200cf3d7
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consistently skip death tests at runtime when using OpenMPI without exceptions
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2020-07-18 13:02:38 -04:00 |
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0748b12472
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when processing quoted strings, the quotes need to be removed
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2020-07-17 13:58:15 -04:00 |
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cdbcacffce
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when processing quoted strings, the quotes need to be removed
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2020-07-17 10:23:07 -04:00 |
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5fe83755b8
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start tester tool for KIM commands
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2020-07-17 02:23:48 -04:00 |
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bf37e6aae1
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Merge branch 'master' into write-bonus-data
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2020-07-15 15:20:34 -04:00 |
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2fb0f95324
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check against BODY package for body styles
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2020-07-14 18:41:52 -04:00 |
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