lammps:4a9ca6eca2a9b0f9e196c0749c390e5cc7077a14 commits - 南方科技大学

Merge pull request #1661 from wmbrownIntel/user-intel-make-update

2019-09-05T14:02:49-04:00

USER-INTEL: Adding explicit include path for MKL and updating benchma…

Merge pull request #1654 from nmhamster/master

2019-09-05T14:00:44-04:00

Add support for Astra/Arm system to LAMMPS build files

Merge pull request #1634 from junghans/kim-api-version

2019-09-05T13:59:46-04:00

cmake: add version check for kim-api

Fix typo

2019-09-04T16:26:03-04:00

USER-INTEL: Adding explicit include path for MKL and updating benchmark script.

2019-09-04T07:53:33-07:00

Add support for Astra/Arm system to LAMMPS build files. Testing on Astra at...

2019-08-29T08:54:37-06:00

Add support for Astra/Arm system to LAMMPS build files. Testing on Astra at Sandia using ATSE environment.

Merge pull request #1642 from lammps/chunk-doc

2019-08-25T20:16:35-04:00

add another example to Howto chunk doc page

Merge pull request #1644 from rbberger/kokkos_cmake_fix

2019-08-25T20:15:38-04:00

Add missing npair style for KOKKOS when using CMake

2019-08-22T18:36:36-04:00

fix typo

2019-08-22T13:46:24-04:00

add another example to Howto chunk doc page

2019-08-22T11:37:21-06:00

Merge pull request #1640 from akohlmey/fix-wall-morse

2019-08-21T22:17:08-04:00

Implement fix wall/morse

update docs to add morse in a similar style to fix wall/region

2019-08-21T17:12:04-04:00

integrate fix wall/morse docs properly into manual

2019-08-21T16:00:14-04:00

implement fix wall/morse based on fix wall/region and fix wall/harmonic

2019-08-21T16:00:14-04:00

Merge pull request #1628 from erozic/feature-wall-region-morse

2019-08-21T11:47:43-04:00

Added "morse" style to the "wall/region" fix

Merge pull request #1641 from rbberger/fix_external_via_python

2019-08-21T10:54:59-04:00

Extend lib interface to allow setting fix external callbacks

Merge pull request #1503 from etomica/master

2019-08-21T00:12:16-04:00

Implement HMA compute in LAMMPS

Merge pull request #1637 from dsbolin/granular_bug_fixes

2019-08-21T00:09:04-04:00

Bug fix for fix/wall/gran

Merge pull request #1621 from akohlmey/collected-small-fixes

2019-08-20T19:36:10-04:00

Collected small fixes and updates

Merge pull request #1626 from erozic/feature-pair-cossq

2019-08-20T19:35:45-04:00

New pair_style cosine/squared

Merge pull request #1638 from ellio167/kim-api-2.1.3

2019-08-20T19:34:44-04:00

bump kim-api to 2.1.3

Silence another compiler warning

2019-08-20T19:28:03-04:00

Silence compiler warning

2019-08-20T19:26:26-04:00

Compute HMA style name should be lowercase (and match the docs)

2019-08-20T19:25:19-04:00

compute HMA style name should be lowercase

2019-08-20T19:24:22-04:00

Increase string buffer size to 128

2019-08-20T16:55:36-06:00

Fix file name

2019-08-20T16:54:37-06:00

Use snprintf instead of sprintf

2019-08-20T16:47:43-06:00

update fix wall/region docs as requested by @sjplimp (i hope)

2019-08-20T16:50:49-04:00

Add missing comment

2019-08-20T14:12:14-06:00

Extend lib interface to set fix external callback

2019-08-20T14:04:49-06:00

This allows creating a callback in Python and attaching it to a fix external instance.

fix spelling issues in docs

2019-08-20T12:05:14-04:00

Merge branch 'master' into collected-small-fixes

2019-08-20T12:01:52-04:00

change order of morse style wall potential parameters to be consistent with...

2019-08-20T11:27:29-04:00

change order of morse style wall potential parameters to be consistent with pair morse and bond morse

Final tweaks to HMA documentation

2019-08-19T18:15:19-04:00

Merge branch 'master' into master

2019-08-19T15:55:39-06:00

Adjust warnings for default kim download behavior settings

2019-08-17T12:04:00-05:00

Revert "Update FindKIM-API.cmake"

2019-08-17T11:40:13-05:00

This reverts commit .

Update FindKIM-API.cmake

2019-08-16T12:05:20-06:00