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2b84cd0524
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2024-07-02 14:47:48 -07:00 |
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44ff2698c5
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2024-07-02 14:47:12 -07:00 |
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b6a007b769
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2024-07-02 14:47:01 -07:00 |
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a170ecc202
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2024-07-02 14:46:49 -07:00 |
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567d492121
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2024-07-02 14:46:35 -07:00 |
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ba675c0806
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2024-07-02 14:46:20 -07:00 |
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b98b82fb09
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2024-07-02 14:45:34 -07:00 |
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6dd47fbbb0
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2024-07-02 14:40:26 -07:00 |
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6ef8472481
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Merge commit 'refs/pull/4168/head' of github.com:lammps/lammps into kokkospod
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2024-06-24 23:52:39 -04:00 |
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e195f1759f
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Remove unused parameters, change command name, and update documentation and examples..
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2024-06-24 22:32:35 -04:00 |
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01a85639f9
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Merge branch 'develop' into kokkospod
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2024-06-23 03:56:39 -04:00 |
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fc539b46ea
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change all function ptrs and 2 example dump files
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2024-06-21 09:23:04 -06:00 |
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8ce284f125
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Merge pull request #4145 from jrgissing/improve_type_label_support
Improve type label support
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2024-06-20 16:30:22 -04:00 |
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734fdf4a46
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rename CG-DNA potential files
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2024-06-20 14:33:26 -04:00 |
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2dc7de417a
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Merge branch 'develop' into improve_type_label_support
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2024-06-20 08:56:02 -04:00 |
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9c8c04a7b4
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Merge branch 'develop' into cg-dna
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2024-06-20 02:44:29 -04:00 |
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629a9cbe3d
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Merge pull request #4188 from Eddy-Barraud/dpd_charged
add pair styles dpd/coul/slater/long and dpd/coul/slater/long/gpu
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2024-06-19 13:50:46 -04:00 |
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4e0bf6137d
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Merge pull request #4110 from uf3/ml-uf3
Implementation of pair_style uf3 and uf3/kk
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2024-06-19 11:43:32 -04:00 |
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6ada6b7bf2
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update example for dpd/coul/slater/long
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2024-06-19 11:00:21 -04:00 |
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a4ac48addf
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add example file and author contrib
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2024-06-14 10:13:48 +02:00 |
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11ef510a93
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Merge branch 'lammps:develop' into improve_type_label_support
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2024-06-13 19:26:42 -04:00 |
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03251e823f
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add terminal newline
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2024-06-13 15:20:12 -04:00 |
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fb23df7bf7
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example input file
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2024-06-13 17:35:45 +02:00 |
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610172b9dc
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Merge branch 'lammps:develop' into cg-dna
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2024-06-12 17:38:20 +01:00 |
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8a94faee58
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Updated i-pi example
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2024-06-04 23:48:17 +02:00 |
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09a57c01da
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Corrected email address
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2024-05-28 11:02:57 +01:00 |
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75a325751e
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implement support for lammps_map_atom() to plugin loader, Fortran module, swig
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2024-05-25 07:01:28 -04:00 |
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2fbfa623cd
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fix fdotr and update the force-styles unittest
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2024-05-22 23:56:16 -04:00 |
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86abf4f680
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Fix input file bug and update examples
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2024-05-22 21:25:31 -04:00 |
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938d117890
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Updated tests to contain full stdout
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2024-05-22 15:53:09 +01:00 |
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749e259294
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Moved test script
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2024-05-22 14:15:48 +01:00 |
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c2e4ad220f
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Update Ta example
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2024-05-22 00:37:47 -04:00 |
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ac561095b1
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Change int* to tagint*
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2024-05-21 21:51:26 -04:00 |
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d42b8ebb6c
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make use of new dump_modify in examples
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2024-05-21 19:40:28 -04:00 |
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4104e73bcd
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Delete InP training data
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2024-05-21 09:45:29 -04:00 |
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44ef81e900
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documentation and examples
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2024-05-21 09:39:36 -04:00 |
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58653e0a87
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Merge branch 'lammps:develop' into cg-dna
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2024-05-20 15:10:52 +01:00 |
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00cb38e823
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real unit and potential file examples (#16)
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2024-05-20 15:08:06 +01:00 |
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b31071e18f
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Removed exit status bug
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2024-05-15 22:03:56 +01:00 |
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c0daa9550a
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Reformatting
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2024-05-15 16:47:44 +01:00 |
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17e0e785ab
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Corrected typo
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2024-05-15 16:45:52 +01:00 |
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a7fe12cd7b
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Reformatting
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2024-05-15 16:07:59 +01:00 |
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0e9c3fb768
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Updated test script
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2024-05-15 15:26:58 +01:00 |
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1f52d1769d
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update ML-UF3 example
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2024-05-13 20:29:20 -04:00 |
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9e755cd0af
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Merge branch 'lammps:develop' into ml-uf3
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2024-05-13 15:10:58 -04:00 |
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74f29ba2f3
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update example
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2024-05-13 14:07:24 -04:00 |
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d0f8d9eeb1
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Merge branch 'develop' into dhairyaiitb/develop
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2024-05-13 13:47:21 -04:00 |
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3028b6f34c
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clean up of docs and code
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2024-05-06 19:16:06 -06:00 |
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a4449fb6ff
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modified doc page, added examples
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2024-05-06 16:44:45 -06:00 |
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3d4bb44911
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Minor rearrangements to CoR, fix bug in granular single
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2024-05-06 16:39:29 -06:00 |
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