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Diffusion lammps (lammm-master) Graph

lammps/src/USER-MISC
lammm-master

History Graph

CommitAuthorDetailsCommitted
bbef0a814a8csjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13722 f3b2605a-c512-4ea7… 
Jul 25 2015
6295fc690850sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13616 f3b2605a-c512-4ea7… 
Jul 17 2015
f7bc08d83d39sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13601 f3b2605a-c512-4ea7… 
Jul 15 2015
f80fb40454c6Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Jul 14 2015
ac35671f8a49sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13568 f3b2605a-c512-4ea7… 
Jul 13 2015
e991597c6096Axel Kohlmeyer
include update/bugfix for compute ackland/atom from brian barnes 
Jul 1 2015
417a56728c39Axel Kohlmeyer
more fixes for C++11 compatibility 
Jun 17 2015
d35e3291a336Axel Kohlmeyer
removed dead code and silence warnings about C++ standard violations 
Jun 17 2015
db1599c2ecdcAxel Kohlmeyer
remove trailing whitespace from SRP code 
Jun 15 2015
a58542235ce3Axel Kohlmeyer
create unique fix ids, so that pair_style srp can be used multiple times 
Jun 15 2015
8e12509c39e9Axel Kohlmeyer
patch from tim sirk that allows applying pair_style srp to all bonds 
Jun 15 2015
6106843d57afsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13467 f3b2605a-c512-4ea7… 
May 15 2015
5bc5c72e4be8Axel Kohlmeyer
fix compilation with cygwin 
Apr 24 2015
187ba17f5a76Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Apr 2 2015
d497d6593084sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13353 f3b2605a-c512-4ea7… 
Apr 1 2015
95e13af098f4Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Apr 1 2015
8428bd3d9db2sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13348 f3b2605a-c512-4ea7… 
Apr 1 2015
e4a631c08454Axel Kohlmeyer
compilation fixes to correct inconsistent changes in the git repo 
Mar 31 2015
cfc5c8b27754sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13343 f3b2605a-c512-4ea7… 
Mar 31 2015
85217cf1b7e3sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13339 f3b2605a-c512-4ea7… 
Mar 31 2015
dd00626ec5d3sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13337 f3b2605a-c512-4ea7… 
Mar 31 2015
6bfac86da34fAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Mar 31 2015
bd37304ade8bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13332 f3b2605a-c512-4ea7… 
Mar 31 2015
5f0a75251391Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Mar 25 2015
25b928b2762asjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13282 f3b2605a-c512-4ea7… 
Mar 24 2015
a4f7f9c868c0Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Mar 5 2015
b33a0164ded0sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13170 f3b2605a-c512-4ea7… 
Mar 4 2015
00834f6d844csjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13127 f3b2605a-c512-4ea7… 
Feb 19 2015
b1dcc1da5577Axel Kohlmeyer
dead code removal from warnings flagged by clang++ but not g++ 
Feb 17 2015
4fdb97ee480fAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Feb 5 2015
25e63c7a0894sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13037 f3b2605a-c512-4ea7… 
Feb 4 2015
8d532d93e929Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Jan 20 2015
4a975dd8cf07sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12957 f3b2605a-c512-4ea7… 
Jan 20 2015
72ac6ea85400sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12956 f3b2605a-c512-4ea7… 
Jan 20 2015
db7aa98b6e9fsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12938 f3b2605a-c512-4ea7… 
Jan 14 2015
fb862de443feAxel Kohlmeyer
fix compilation with -DLAMMPS_BIGBIG 
Jan 14 2015
5838c3c5428eAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Jan 6 2015
1aefa8d62472sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12859 f3b2605a-c512-4ea7… 
Jan 5 2015
ced125c2b4e7sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12819 f3b2605a-c512-4ea7… 
Dec 5 2014
d64c77b83cddAxel Kohlmeyer
import maintenance patch from michele ceriotti for fix gle and fix ipi 
Dec 4 2014
4529a6c72607Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Dec 4 2014
aeb7fec23aa9sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12814 f3b2605a-c512-4ea7… 
Dec 2 2014
74ba3d309508Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Dec 1 2014
362f7ad110e7sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12808 f3b2605a-c512-4ea7… 
Dec 1 2014
b893e39fbafbAxel Kohlmeyer
add missing C++ emacs cookies to recently added header files 
Nov 26 2014
eb8b18913b41sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12798 f3b2605a-c512-4ea7… 
Nov 26 2014
cb0a9998bd92Axel Kohlmeyer
use MPI_STATUS_IGNORE where possible 
Nov 25 2014
475aa20270a7Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Nov 25 2014
c8207561695dsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12794 f3b2605a-c512-4ea7… 
Nov 25 2014
fe42affff424sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12792 f3b2605a-c512-4ea7… 
Nov 24 2014
1f84af1b9165sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12788 f3b2605a-c512-4ea7… 
Nov 24 2014
6ee2f9f3e394sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12779 f3b2605a-c512-4ea7… 
Nov 24 2014
11bd1a45ed40sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12775 f3b2605a-c512-4ea7… 
Nov 24 2014
162e8050ad6bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12773 f3b2605a-c512-4ea7… 
Nov 24 2014
6f05cb448353Axel Kohlmeyer
put back c++ emacs cookies 
Nov 20 2014
8f5063b26e7bAxel Kohlmeyer
dead code removal and format cleanups 
Nov 19 2014
d865a1d8e56fAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Nov 19 2014
e4c84f31caaasjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12720 f3b2605a-c512-4ea7… 
Nov 18 2014
416f6c25e56dAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Nov 18 2014
21ac09ad9c9csjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12715 f3b2605a-c512-4ea7… 
Nov 18 2014
b7ece0fb5183sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12693 f3b2605a-c512-4ea7… 
Nov 17 2014
7518fae9bcffsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12641 f3b2605a-c512-4ea7… 
Oct 21 2014
35d8036e3236Axel Kohlmeyer
update C++ headers with emacs mode cookies 
Oct 21 2014
251660040393sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12579 f3b2605a-c512-4ea7… 
Oct 1 2014
3a5d4208f3d5Axel Kohlmeyer
safer call to generation of occasional neighbor lists. cleaner implementation… 
Sep 30 2014
777e82995de2sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12406 f3b2605a-c512-4ea7… 
Sep 5 2014
ca6b61d07f79Axel Kohlmeyer
remove definitions obsoleted by changes to lmptype.h 
Aug 23 2014
dbc55a403f74Axel Kohlmeyer
overhaul of fix ipi to be more consistent with LAMMPS programming conventions 
Aug 12 2014
e2352387fb51Axel Kohlmeyer
some clarification of domain socket name. ifdef out include files on windows 
Aug 12 2014
76a61445d880Axel Kohlmeyer
add fix ipi for path integrals via python frontend 
Aug 11 2014
2d5428bee038Axel Kohlmeyer
minor corrections to GLE code from michele ceriotti 
Aug 11 2014
4a197537c015Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Aug 7 2014
ad4d9d88b873Axel Kohlmeyer
include optimized matrix-matrix multiplication 
Aug 7 2014
ce4bea7aac5cAxel Kohlmeyer
replace unsigned long with int and simplify C reinit. 
Aug 6 2014
2cca37351548sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12253 f3b2605a-c512-4ea7… 
Aug 6 2014
57b8a339eb7eAxel Kohlmeyer
clean up reading of C matrix and fix missing scaling bug 
Aug 5 2014
8821eb0518c9Axel Kohlmeyer
cleaned up code some. doesn't seem to fully work yet. 
Aug 5 2014
2056624858dfAxel Kohlmeyer
remove trailing whitespace 
Aug 5 2014
5e98c4a3e617Axel Kohlmeyer
some simple cleanup and correction to C++ style and syntax 
Aug 5 2014
ff3961492620Axel Kohlmeyer
import updated GLE fix from michele ceriotti 
Aug 5 2014
29ae4bd8dc3dAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Jul 1 2014
026ff1f6dd4fsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12144 f3b2605a-c512-4ea7… 
Jun 27 2014
4acacd8e3b18Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
May 8 2014
53db68362ec1sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11935 f3b2605a-c512-4ea7… 
May 7 2014
8bee4ef5966asjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11907 f3b2605a-c512-4ea7… 
May 2 2014
0fbda306f930Axel Kohlmeyer
next batch of code cleanup based on compiler warnings 
Apr 30 2014
f461504c9398sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11829 f3b2605a-c512-4ea7… 
Apr 18 2014
9374001aadd4Axel Kohlmeyer
next batch of unused variable removal 
Apr 16 2014
492e027896e6Axel Kohlmeyer
some more cleanups based on warnings from newer gcc 
Apr 16 2014
1fac1d41fa78sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11789 f3b2605a-c512-4ea7… 
Apr 15 2014
d7bbb795fff0Axel Kohlmeyer
spelling fix 
Apr 12 2014
323e3075c413Axel Kohlmeyer
remove even more unused variables and have consistent initialization 
Apr 12 2014
09168613150esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11777 f3b2605a-c512-4ea7… 
Apr 11 2014
5fcfc9f575fcAxel Kohlmeyer
various little cleanups to silence compiler warnings 
Apr 10 2014
eabcf5cd7dbdsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11732 f3b2605a-c512-4ea7… 
Apr 7 2014
9ca0fa9029beAxel Kohlmeyer
make pair style tersoff/table/omp thread safe 
Apr 5 2014
0de9e4252ba7sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11701 f3b2605a-c512-4ea7… 
Apr 4 2014
573db9e2f7e7Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Mar 12 2014
61af28265478Axel Kohlmeyer
move open_potential() from pair.cpp to force.cpp and extend to bonds/angles 
Feb 14 2014
1a8ee73f0abcsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11561 f3b2605a-c512-4ea7… 
Feb 13 2014
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