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6909bc234a
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Merge pull request #2700 from rbberger/python_calls_refactor
Python package refactor
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2021-04-07 13:35:53 -04:00 |
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5af294d49e
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Update test_potential_file_reader.cpp
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2021-04-06 16:47:06 -04:00 |
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e00e2676fc
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add tests for utils::open_potential()
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2021-04-04 22:23:13 -04:00 |
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664335420a
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Start refactoring tests
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2021-03-26 11:50:58 -04:00 |
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487c55edf0
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simplify and apply clang-format
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2021-03-24 11:24:55 -04:00 |
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569a000e6b
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reformat unittest sources with clang-format
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2020-11-25 16:51:41 -05:00 |
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adf74b3a22
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use https://lammps.sandia.gov based URLs consistently
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2020-10-21 16:45:30 -04:00 |
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f19ce32bf5
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a few more small tweaks
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2020-09-04 09:42:11 -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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d32000239b
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refactor tester
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2020-07-11 13:05:03 -04:00 |
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0b298c7193
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add tests for supported and unsupported unit conversion when opening potentials
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2020-07-02 23:07:01 -04:00 |
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5c08ce0818
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nb3b/harmonic parameters are in real units
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2020-06-29 13:28:32 -04:00 |
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22d8d0d0b0
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add tests for potential file reader and untils functions
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2020-06-25 08:00:04 -04:00 |
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00332d299b
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add unit conversion support to pair style tersoff/table
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2020-06-24 21:05:00 -04:00 |
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2af8d7a751
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add argument passing via TEST_ARGS environment variable to all tests with an explicit main function
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2020-06-24 10:17:23 -04:00 |
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e88bb9dd59
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call MPI_Finalize() so we don't have spurious memory leaks from MPI reported by valgrind
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2020-06-17 01:42:17 -04:00 |
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b5a809413e
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set units for potential file reader tests. allow verbose execution.
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2020-06-16 06:19:31 -04:00 |
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9c3d108bbc
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enable aligning consecutive assignments
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2020-06-13 02:05:13 -04:00 |
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3db944decc
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apply clang-format settings to the c++ sources in the unittest tree
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2020-06-13 01:54:58 -04:00 |
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644ef3da4c
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add LAMMPS copyright header
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2020-06-01 19:08:59 -04:00 |
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10b0d60709
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Fix typo
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2020-05-29 14:56:10 -04:00 |
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5a4bbcc37a
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Update pair vashishta
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2020-05-28 16:17:15 -04:00 |
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cadc374e0b
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Update pair nb3b harmonic
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2020-05-28 16:05:56 -04:00 |
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e206647717
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Update pair gw zbl
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2020-05-28 15:56:36 -04:00 |
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2632d30970
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Update pair gw
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2020-05-28 15:44:53 -04:00 |
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f5d8417d96
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Update pair tersoff zbl
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2020-05-28 10:36:20 -04:00 |
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c0324e55ad
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Update pair tersoff mod c
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2020-05-28 10:06:43 -04:00 |
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8329a5498b
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Move NPARAMS_PER_LINE to parent classes
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2020-05-28 09:48:34 -04:00 |
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2eaf710488
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Hide stdout during tests
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2020-05-28 08:01:54 -04:00 |
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507064d45d
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Add Tersoff potential file read test
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2020-05-27 13:13:50 -04:00 |
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6d339c8b03
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Add unit tests for PotentialFileReader
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2020-05-27 13:02:39 -04:00 |
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