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Diffusion lammps (lammps-icms) Graph

lammps/src
lammps-icms

History Graph

CommitAuthorDetailsCommitted
e7e5ba4e4688Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Sep 23 2016
32cec47ffb36sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15631 f3b2605a-c512-4ea7… 
Sep 22 2016
fd2ac15c2eadAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Sep 22 2016
e6ac7757a374Axel Kohlmeyer
fix bug in fix_modify respa reported by steven early strong on lammps-users 
Sep 22 2016
32872a7b35f0sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15628 f3b2605a-c512-4ea7… 
Sep 22 2016
26e16ed9681dsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15625 f3b2605a-c512-4ea7… 
Sep 22 2016
72c5792230bfsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15615 f3b2605a-c512-4ea7… 
Sep 21 2016
71f7dde12acbsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15614 f3b2605a-c512-4ea7… 
Sep 21 2016
41b945d0514cAxel Kohlmeyer
restore bugfixes and updates that were lost. flag time dependet. correct use of… 
Sep 21 2016
6b3c505fbee3Axel Kohlmeyer
need to add removed fix ti/rs to purge list 
Sep 21 2016
d298283b5671Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Sep 21 2016
3eee5849565bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15612 f3b2605a-c512-4ea7… 
Sep 20 2016
26b9b955a96fsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15611 f3b2605a-c512-4ea7… 
Sep 20 2016
f86bd1fcebcbsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15607 f3b2605a-c512-4ea7… 
Sep 20 2016
f1d3637b0387sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15605 f3b2605a-c512-4ea7… 
Sep 20 2016
f81f0da7341dsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15603 f3b2605a-c512-4ea7… 
Sep 20 2016
ed9f13663bacsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15602 f3b2605a-c512-4ea7… 
Sep 20 2016
558303072d04sjplimp
sync with GH 
Sep 20 2016
1dbd52a30cf7Axel Kohlmeyer
remove debug code 
Sep 20 2016
7cc79de530b8Axel Kohlmeyer
demote OMP_NUM_THREAD "warning" to "message" in the hope to be less confusing… 
Sep 20 2016
bc11518960b8Axel Kohlmeyer
fix argument indexing bug in fix ave/atom 
Sep 20 2016
34ccbd726601Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Sep 19 2016
900c83960e6fsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15595 f3b2605a-c512-4ea7… 
Sep 18 2016
6eca661e4a54Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Sep 17 2016
484122b8b610sjplimp
sync with GH 
Sep 16 2016
d66493ca13c8Axel Kohlmeyer
whitespace cleanup 
Sep 16 2016
21777f52604fAxel Kohlmeyer
permissions cleanup 
Sep 16 2016
0197738285aeAxel Kohlmeyer
Merge branch 'lammps-icms' of bitbucket.org:akohlmey/lammps-icms into lammps… 
Sep 16 2016
1ba7f726cce2Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Sep 16 2016
e14eab610e78sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15582 f3b2605a-c512-4ea7… 
Sep 15 2016
e30420fc464fAxel Kohlmeyer
make certain, that -log() doesn't overflow and assign a suitable maximum number… 
Sep 15 2016
2049fa738045sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15581 f3b2605a-c512-4ea7… 
Sep 15 2016
cf33c0e7fba4sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15580 f3b2605a-c512-4ea7… 
Sep 15 2016
db1e17197fcfAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Sep 15 2016
b23e9f0d548esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15579 f3b2605a-c512-4ea7… 
Sep 14 2016
0f6d21acda7bsjplimp
sync with Git 
Sep 14 2016
3b4412d782efAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Sep 14 2016
b3fa20718f0csjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15572 f3b2605a-c512-4ea7… 
Sep 14 2016
babaa839b0c2sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15570 f3b2605a-c512-4ea7… 
Sep 14 2016
9f3118341a30sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15569 f3b2605a-c512-4ea7… 
Sep 13 2016
423052134b98sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15567 f3b2605a-c512-4ea7… 
Sep 13 2016
a2b4a794d9a2Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Sep 13 2016
d913f5e09409stamoor
Fixing Kokkos bugs 
Sep 12 2016
38356949ba42Efrem Braun
Moved test for ghost atom velocities to the ::init() method 
Sep 12 2016
7d70a5982721Efrem Braun
Only check for comm_modify vel yes if need be 
Sep 12 2016
f96ef7c45ec1Efrem Braun
Changed back stxcmp to strcmp 
Sep 12 2016
f99296e7488eEfrem Braun
Removed unused variable 
Sep 12 2016
780c13bc3ce7Efrem Braun
Made error message if not comm_modify vel yes 
Sep 12 2016
d3239a3bdc65Efrem Braun
Added comments for legibility purposes 
Sep 12 2016
dcc6a175c8a0Efrem Braun
Made calculation of bond kinetic energies simpler, and replaced calculation of… 
Sep 12 2016
fe49cbe4cc1fAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Sep 11 2016
a8d7ca367de4sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15564 f3b2605a-c512-4ea7… 
Sep 10 2016
2b53f8039216Axel Kohlmeyer
require an atom map for compute voronoi/atom occupation 
Sep 9 2016
ed7d2d42252fAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Sep 9 2016
ad2ccf6f2725Axel Kohlmeyer
implement vashishta/table/omp in USER-OMP 
Sep 8 2016
d2a02eaa56b7Axel Kohlmeyer
ignore all variants of the vashishta pair styles in src/ 
Sep 8 2016
a46098c89982Steve Plimpton/Axel Kohlmeyer
undo changes to vashishita/omp 
Sep 8 2016
4353fe8d91ceAxel Kohlmeyer
created vashishta/table variant 
Sep 8 2016
1dd7a13d8233sjplimp
sync with GH 
Sep 8 2016
b190abea390esjplimp
sync with GH 
Sep 8 2016
39338865845aAxel Kohlmeyer
delete duplicate fclose() in fix ttm/mod constructor 
Sep 8 2016
f8e659f44be7Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Sep 8 2016
06b7d56e168fsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15560 f3b2605a-c512-4ea7… 
Sep 7 2016
ee4a1f0452cesjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15559 f3b2605a-c512-4ea7… 
Sep 7 2016
d3694613fd91sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15558 f3b2605a-c512-4ea7… 
Sep 7 2016
b0940dec80b5Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Sep 7 2016
ea9bcda82ebfAxel Kohlmeyer
revert changes to group.cpp and compute_omega_chunk.cpp to accommodate changes… 
Sep 7 2016
bf0c18a0f238sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15557 f3b2605a-c512-4ea7… 
Sep 7 2016
f67a9722eaf7sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15554 f3b2605a-c512-4ea7… 
Sep 7 2016
83f139642eb6stamoor
Reverting optimizations that hurt performance on some compilers 
Sep 7 2016
74d0bc4df6f6sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15548 f3b2605a-c512-4ea7… 
Sep 7 2016
56945a56aabesjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15547 f3b2605a-c512-4ea7… 
Sep 6 2016
9625b99ba7a0Axel Kohlmeyer
Merge branch 'lammps-icms' of https://github.com/efremdan1/lammps into merge… 
Sep 6 2016
1ce11d2227f0Efrem Braun
Made documentation and code of last commit more legible 
Sep 6 2016
626ae8d85cb9sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15544 f3b2605a-c512-4ea7… 
Sep 6 2016
4282107e5d91sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15543 f3b2605a-c512-4ea7… 
Sep 6 2016
688b1f1efc46stamoor
Fixing bug in Kokkos ReaxFF 
Sep 6 2016
245c70e91686Efrem Braun
added in option to compute_bond_local to calculate bond velocities and kinetic… 
Sep 5 2016
76e063887acfTim Mattox
Fix a bug introduced in commit 2af907a. Thanks to efremdan1 for finding it. 
Sep 5 2016
83986c9d1aecAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Sep 3 2016
fc80281fd990stamoor
Fixing bugs in per-atom 
Sep 3 2016
222e9de4c889Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Sep 2 2016
519a3ee242d4stamoor
Adding Kokkos version of PPPM 
Sep 1 2016
b4785cd03877stamoor
Adding Kokkos version of PPPM 
Sep 1 2016
1c54dc77ea6cAxel Kohlmeyer
simplify phonon code some more 
Sep 1 2016
35759133792aAxel Kohlmeyer
simplify code 
Sep 1 2016
214494477854Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Sep 1 2016
fab2f01a5844sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15531 f3b2605a-c512-4ea7… 
Sep 1 2016
ae458497bfd3sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15530 f3b2605a-c512-4ea7… 
Aug 31 2016
93c6c26b8396sjplimp
sync with Git 
Aug 31 2016
083ff54c0c51sjplimp
small bug fixes 
Aug 31 2016
e3d0a322729esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15526 f3b2605a-c512-4ea7… 
Aug 31 2016
9d8027c90008sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15524 f3b2605a-c512-4ea7… 
Aug 31 2016
a236af80eab5Axel Kohlmeyer
Merge branch 'lammps-icms' of bitbucket.org:akohlmey/lammps-icms into lammps… 
Aug 31 2016
35c23a19612cAxel Kohlmeyer
restore pointer NULLifying for fix balance 
Aug 31 2016
ccb3c31b0e2aAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Aug 31 2016
76acb8caf15fstamoor
Fixing Kokkos memory issue 
Aug 31 2016
2af907a10d94Axel Kohlmeyer
change angular velocity computation for groups/chunks to handle (near) zero… 
Aug 30 2016
7875009218a7Axel Kohlmeyer
fix typo in comments 
Aug 30 2016
ba444a4c6bffsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15522 f3b2605a-c512-4ea7… 
Aug 30 2016
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