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9c0808e95a
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update unit tests for move of version string location
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2020-09-19 15:00:03 -04:00 |
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0522e3d7b6
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a few more unittest tweaks
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2020-09-17 11:11:44 -04:00 |
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00641f9f24
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relax epsilon a little for passing cross-platform tests
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2020-09-17 11:01:59 -04:00 |
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e2fc70da62
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Merge branch 'master' into collected-small-changes
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2020-09-17 06:51:21 -04:00 |
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b9919b72d7
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make MSM test w/o PBC run faster
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2020-09-16 23:36:17 -04:00 |
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0931cdd109
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relax epsilon for rigid body integrators
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2020-09-16 14:07:28 -04:00 |
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981d60f1bd
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update rigid tests for new eigensolver
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2020-09-15 22:47:52 -04:00 |
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0f6a34775c
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Merge branch 'master' into symbolic-atom-constants
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2020-09-15 17:44:31 -04:00 |
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618b08dcfc
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Merge branch 'master' into symbolic-atom-constants
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2020-09-15 14:58:13 -04:00 |
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3dd3c6a2a5
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redo fix for class member shadowing while avoiding overflowing levels
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2020-09-15 14:48:55 -04:00 |
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b5832191d8
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Merge pull request #2364 from akohlmey/force-test-bugfix
Force style unit test template bugfix
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2020-09-15 13:40:13 -04:00 |
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e30864431f
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add test for missing quartic bond style
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2020-09-15 10:12:18 -04:00 |
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238730b13d
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update epsilon
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2020-09-15 09:55:58 -04:00 |
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c6b6369d2d
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fix bug in input script templates that would have the timestep setting overwritten by a units command
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2020-09-15 09:46:57 -04:00 |
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69962b4de5
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add test for MSM kspace without periodic boundaries
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2020-09-12 11:10:38 -04:00 |
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47b3039b28
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update unit tests, too
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2020-09-11 19:24:32 -04:00 |
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2ffb5ddd5a
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add kspace dependency to coul/streitz/long test
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2020-09-01 17:34:08 -04:00 |
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b1cca2cf74
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update reference data for molecular test with pair style beck
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2020-08-27 19:00:20 -04:00 |
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fa13e23f7a
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add atomic test for gauss pair style
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2020-08-27 17:41:25 -04:00 |
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fdb726629f
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revert "fix" for pair style beck/gpu and correct beck and beck/omp instead
we should consistently apply factor_lj for both, force and energy, or not
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2020-08-27 17:14:05 -04:00 |
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14b66d1f84
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tweak test tolerance of reax/c tests for running on ubuntu 18.04
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2020-08-25 12:15:19 -04:00 |
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47a44732e7
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add test for fix restrain
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2020-08-23 15:29:58 -04:00 |
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fb634658de
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add tests for a few more force manipulation fixes
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2020-08-23 07:01:38 -04:00 |
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c503bba008
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add custom pair style tests for reax/c and edip/multi
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2020-08-23 06:44:33 -04:00 |
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0fb8f6e779
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add test for pair style momb
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2020-08-22 23:15:20 -04:00 |
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66b17fd2ce
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dispersion only tests for buckingham
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2020-08-22 23:03:20 -04:00 |
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3def826dbe
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add more tests for variants using long-range dispersion pair styles
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2020-08-22 22:55:15 -04:00 |
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c8f2634b44
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add tests for tabulated msm coulomb
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2020-08-22 22:08:08 -04:00 |
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e78100bdba
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add (partial) tests for pair styles dpd and dpd/tstat
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2020-08-22 22:00:13 -04:00 |
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4c46119a48
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Merge pull request #2280 from lammps/gridcomm-tiled
Support for tiled decompositions in PPPM
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2020-08-21 00:16:20 -04:00 |
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42018d3b35
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add dispersion only kspace style tests
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2020-08-20 23:42:23 -04:00 |
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a742db2369
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add a couple of kspace tests using tiled communication
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2020-08-20 18:08:10 -04:00 |
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cd7ba1d007
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Merge branch 'master' into more-fix-tests
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2020-08-20 16:41:29 -04:00 |
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f0335fabb1
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Merge pull request #2295 from akohlmey/add-fix-momentum-chunk
Add fix momentum/chunk
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2020-08-20 16:40:51 -04:00 |
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5306b39251
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add tests for a few more wall fixes
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2020-08-20 15:42:00 -04:00 |
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56d00e115d
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add more tests for fixes
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2020-08-20 15:32:47 -04:00 |
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ba00626764
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more force adding fix tests
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2020-08-20 10:59:39 -04:00 |
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e72ea35c40
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add tests for a bunch of rigid fixes
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2020-08-20 10:10:25 -04:00 |
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ca7fa2aeef
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make names of fix-timestep inputs consistent with the rest
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2020-08-20 09:25:40 -04:00 |
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20c24b1f3b
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add tests for momentum fixes and nve/limit
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2020-08-19 15:08:46 -04:00 |
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b1fbee9bd0
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skip testing fix nve/limit for r-RESPA as it is not compatible by design
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2020-08-19 15:08:32 -04:00 |
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1413e61553
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tweak test presision so it passes with more compilers
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2020-08-19 00:59:50 -04:00 |
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5050538d59
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add tests for addforce and aveforce fixes
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2020-08-11 21:00:16 -04:00 |
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4cfc920d65
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remove unused variable
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2020-08-11 19:58:51 -04:00 |
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51a7038dbf
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Merge branch 'master' into fix-tester
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2020-08-11 16:14:27 -04:00 |
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11af732aab
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tweak precision for edip test
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2020-08-11 15:43:03 -04:00 |
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65d9eef707
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add test for pair style extep
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2020-08-11 09:57:32 -04:00 |
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6b84cd1c48
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add test for pair style morse/smooth/linear
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2020-08-11 09:57:23 -04:00 |
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5c0ec78cd2
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add test for pair style e3b
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2020-08-11 08:57:40 -04:00 |
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172435b662
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add tests for lj/expand/coul/long
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2020-08-11 08:38:42 -04:00 |
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