lammps:b3bc5fd823ef6b2530d9d5c61df5a63a876e98de commits - 南方科技大学 https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commits/b3bc5fd823ef6b2530d9d5c61df5a63a876e98de 2018-06-29T00:09:51-04:00 https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/b3bc5fd823ef6b2530d9d5c61df5a63a876e98de Merge branch 'record-compile-flags' of https://github.com/akohlmey/lammps int... 2018-06-29T00:09:51-04:00 Axel Kohlmeyer akohlmey@gmail.com Merge branch 'record-compile-flags' of <a href="https://github.com/akohlmey/lammps" rel="nofollow noreferrer noopener" target="_blank">https://github.com/akohlmey/lammps</a> into collected-cmake-changes https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/ad3d049eddabd8ad8e815a0c9a971cc9fbdeb5bb Merge pull request #974 from akohlmey/moltemplate-2.8.6 2018-06-28T07:34:52-06:00 Steve Plimpton sjplimp@sandia.gov Update moltemplate tool to version 2.8.6 https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/7abc960d3932d1cbbb495aa315077df810fb4dd4 import moltemplate 2.8.6 from andrew jewett 2018-06-28T08:18:35-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/6bd5a3d69b4bd0816174fbba59c2f5024e0052b0 Merge pull request #935 from julient31/spin_origin 2018-06-27T16:58:27-06:00 Steve Plimpton sjplimp@sandia.gov Spin origin https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/086e83456b4740d9523f6eeb65deeae735bf34be Merge pull request #970 from jrgissing/bond/react-optional-EdgeIDs 2018-06-27T16:52:41-06:00 Steve Plimpton sjplimp@sandia.gov Bond/react: edge IDs optional https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/1db4705a3dcb27c103660250aacfab1dfad7fad4 Merge pull request #966 from wmbrownIntel/user-intel-2018Jun 2018-06-27T16:52:16-06:00 Steve Plimpton sjplimp@sandia.gov Intel Package: Bug fix when using LRT with minimize and for virial calculation with GNU... https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/8e77be0848e57c8104e7e3e02b00d610ad092424 Merge pull request #967 from lammps/latte-tweak2 2018-06-27T16:44:25-06:00 Steve Plimpton sjplimp@sandia.gov small changes to last LATTE PR, including xControl to upper case https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/fc3694189ede9d3f43b27b26e210e421b46931c7 update CODEOWNERS file for LATTE 2018-06-27T17:01:49-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/75aacfd17fbe09c74c7120e362a8e2e6e09483bc add explanation comment to ABIVERSION define 2018-06-27T16:58:58-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/08552fefe937ad08f2fc77b49ad3c0b74ddb74cc add md5 checksum support to Install.py for LATTE 2018-06-27T16:52:28-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/38cdc1828dd88fafdf994ae7748d4183f91008b7 insert spin package into make and cmake build system 2018-06-27T15:29:24-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/58559d9e62ff2285aee793bd2fe12a73fc2573fd update src/.gitignor for SPIN package sources 2018-06-27T14:08:54-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/3eed23d3f7c961db06b28559dfa80267d5b20c6d whitespace cleanup 2018-06-27T14:07:09-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/d3b83885d1f8e86bd860ace06f2aa954190c3126 make SPIN package examples consistent with other examples and add reference logs 2018-06-27T14:06:56-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/3549345830e73e1dc2d67ec02a303ab8dd46508c whitespace cleanup 2018-06-27T12:30:19-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/244963aa195f1bb345f25f47f1b7fa3fb831033e fix incorrect scaling of emag bug 2018-06-27T12:29:34-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/5c4bf8ac47935b49d590b3c7d6ae47fa5e3e0bc7 bond/react: optional EdgeIDs take2 2018-06-26T20:40:02-06:00 jrgissing jrgiss05@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/6008cee6aa322646f872f30c50b73589ac44c553 ...and replace with symbolic links 2018-06-26T16:02:56-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/f33a2c982c2005468f44c5f834aa8babf8bb885a remove redundant potential files 2018-06-26T16:01:54-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/8e141439080c574a93f5c6591cfd613b4c2683c2 Merge pull request #925 from PabloPiaggi/pair_entropy 2018-06-26T13:16:09-06:00 Steve Plimpton sjplimp@sandia.gov Pair entropy fingerprint https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/e6ef8ce5ee2ddd53c3638c9f60eea347a6125b34 Merge pull request #968 from oywg11/github-tutorial-update 2018-06-26T13:14:22-06:00 Steve Plimpton sjplimp@sandia.gov New paramteters for potential #839 https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/ebe622ff7d7a2ba4ee46c07b96b5ba6d48d52d24 make edge atoms optional 2018-06-26T09:35:38-06:00 jrgissing jrgiss05@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/f94cdf856c1e1b4493ed655d3760bcb5e6dde8a7 Merge pull request #18 from lammps/master 2018-06-26T10:15:52-05:00 Jacob Gissinger jrgiss05@gmail.com rebase https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/e2622f0230a840ec89330c10fbe9c0acc0f86c53 Remap the paragraph 2018-06-26T17:27:55+03:00 oywg11 w.g.ouyang@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/e4dd6dec404e348cc0369ca3ca90ad20a51d2117 Refine the documentation 2018-06-26T16:36:16+03:00 oywg11 w.g.ouyang@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/b0126dd9d6a0cbd66f6cc1ae4e499af206497ab2 updata potential file CH.KC 2018-06-26T16:09:42+03:00 oywg11 w.g.ouyang@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/f36e1a2cdc6e2d297ccbfc65dc2a1c78060fe1bb Changed default deltabin from 2 to 3 2018-06-26T13:06:04+02:00 PabloPiaggi ppiaggi@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/c9d147c366fc730249730b17842af1c172cf2609 New paramteters for potential #839 2018-06-26T11:09:48+03:00 oywg11 w.g.ouyang@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/19f81e080263213dbc5fb95109f6892c380c4694 Add library functions for accessing LAMMPS configuration 2018-06-25T23:56:18-04:00 Richard Berger richard.berger@temple.edu https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/49a91db0b20fcba1741800afdf5db6ef89baf459 small changes to last LATTE PR, including xControl to upper case 2018-06-25T17:43:31-06:00 Steven J. Plimpton sjplimp@singsing.sandia.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/5e485657611c6056e736989740744f81b6bedc03 Merge pull request #961 from cnegre/newsystem 2018-06-25T17:20:57-06:00 Steve Plimpton sjplimp@sandia.gov Added newsystem flag to be passed to latte https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/af91f7fa5d83ba40bd9b40f06cb37f190c7a6e4b LAMMPS does not build on windows without this one 2018-06-25T18:13:41-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/0cd86bab229dc5a668c57043d0f0d232017c2b5d Added new checksum value 2018-06-25T14:58:49-06:00 Christian F. A. Negre christianfannegre@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/bec82e404508335aa66805eb7b9ef776657d8130 Added new checksum value 2018-06-25T14:23:44-06:00 Christian F. A. Negre christianfannegre@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/06b3209ad8d214f6380a3bd363c18082c578e3c7 Commit JT 062518 2018-06-25T09:56:39-06:00 julient31 julien.tranchida1@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/2fd45050cdebbd1117b82b60da78d198479c88ff Merge branch 'newsystem' of https://github.com/cnegre/lammps into newsystem 2018-06-25T08:44:57-06:00 Christian F. A. Negre christianfannegre@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/8ffa96c9e9d9c4684e5a1e72ec0b9468c22f1058 Added fix latte 2018-06-25T08:43:00-06:00 Christian F. A. Negre christianfannegre@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/6a9251245c8615c177e79505a7f428d2b9d2bca9 update MD5 sum for latte-v1.2.0.tar.gz src archive 2018-06-25T09:43:37-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/9108306c119c62fa3c387a8788b7196f2af42b5d Shorter entropy/atom example 2018-06-24T00:36:09+02:00 PabloPiaggi ppiaggi@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/86519ce213f3341313922efd41407e5751036386 Rename compute to entropy/atom 2018-06-24T00:25:07+02:00 PabloPiaggi ppiaggi@gmail.com