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Diffusion lammps (lammm-master-deprecated) Graph

lammps/src/KSPACE
lammm-master-deprecated

History Graph

CommitAuthorDetailsCommitted
3c7da9308eefAxel Kohlmeyer
added code to use collective MPI operations for data remap in 3d-FFT 
Oct 9 2013
9714f43e5095Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Sep 29 2013
3356e5347620athomps
Eliminated kmax=0 for triclinic 
Sep 27 2013
0bf07f466d6csjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10661 f3b2605a-c512-4ea7… 
Aug 23 2013
406a423c7eddAxel Kohlmeyer
safer handling of setflag and labeling of tip4p input errors 
Aug 21 2013
3b06646a184aAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Aug 21 2013
9af873dddb70sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10599 f3b2605a-c512-4ea7… 
Aug 19 2013
7c7617f7e5ecAxel Kohlmeyer
only update the charged particles list after reneighboring 
Aug 3 2013
5b2056130a88Axel Kohlmeyer
add serial and mt version of pppm/tip4p/cg 
Aug 1 2013
77f06b1dfec1Axel Kohlmeyer
Merge remote branch 'lammps-ro/master' into lammps-icms 
Jul 31 2013
5b00a238c313sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10499 f3b2605a-c512-4ea7… 
Jul 30 2013
bf68ab6e3bc4Axel Kohlmeyer
remove references to old-style citeme calls 
Jul 27 2013
f086c6d5fbafsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10417 f3b2605a-c512-4ea7… 
Jul 26 2013
a00c94fa293cAxel Kohlmeyer
rename LOOP timer to TOTAL and implement timers command 
Jul 25 2013
1bc62d40b215Axel Kohlmeyer
more mostly cosmetic issues found by clang 
Jul 24 2013
3d122eee39cdsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10325 f3b2605a-c512-4ea7… 
Jul 24 2013
f6484736ec08Axel Kohlmeyer
Merge remote branch 'lammps-ro/master' into lammps-icms 
Jul 24 2013
4b21fc7c81e8sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10306 f3b2605a-c512-4ea7… 
Jul 23 2013
04b2bbfc4383sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10302 f3b2605a-c512-4ea7… 
Jul 23 2013
ba877e83ca68sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10291 f3b2605a-c512-4ea7… 
Jul 23 2013
42408bc41dbdsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10290 f3b2605a-c512-4ea7… 
Jul 23 2013
2584cbe902e1sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10289 f3b2605a-c512-4ea7… 
Jul 23 2013
366484eb34e9sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10284 f3b2605a-c512-4ea7… 
Jul 23 2013
481bcc774b67sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10283 f3b2605a-c512-4ea7… 
Jul 23 2013
a8b550100874Axel Kohlmeyer
undo part of the bugfix to be in sync with steve's version 
Jul 23 2013
69fd52746cfeAxel Kohlmeyer
Merge branch 'lammps-ro/master' (early part) into lammps-icms 
Jul 23 2013
2135141fe968sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10282 f3b2605a-c512-4ea7… 
Jul 23 2013
c102c621e339sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10277 f3b2605a-c512-4ea7… 
Jul 23 2013
580bffefeae8sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10273 f3b2605a-c512-4ea7… 
Jul 23 2013
d255952ed9f3Axel Kohlmeyer
correct error messages and docs. add /omp version for tip4p/long 
Jul 22 2013
94011f1fa0c7Axel Kohlmeyer
add a coulomb-only pair style for tip4p 
Jul 22 2013
07ea228eda66Axel Kohlmeyer
add write_data support to some more styles 
Jul 22 2013
ec3f67d751b7Axel Kohlmeyer
changes for increased portability to unusual compilers 
Jul 16 2013
eeca24f30d35Axel Kohlmeyer
cleanup based on clang warnings 
Jul 14 2013
16fb07bee832Axel Kohlmeyer
enable recently added write data support 
Jul 11 2013
90e7be08f41eAxel Kohlmeyer
add more support for write_data to lj pair styles 
Jul 11 2013
873b9fe14d83Axel Kohlmeyer
add first list of publications skimmed off the LAMMPS homepage 
Jul 2 2013
6553258ee993Axel Kohlmeyer
Merge remote branch 'lammps-ro/master' into lammps-icms 
Jun 30 2013
b0007d45b732sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10199 f3b2605a-c512-4ea7… 
Jun 29 2013
ce91adefc17bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10197 f3b2605a-c512-4ea7… 
Jun 29 2013
f37ae6cb7476sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10161 f3b2605a-c512-4ea7… 
Jun 28 2013
1c337c837cacAxel Kohlmeyer
permission cleanup 
Jun 28 2013
2b1e3a30bd1aAxel Kohlmeyer
Merge remote branch 'lammps-ro/master' into lammps-icms 
Jun 28 2013
ede1d487733bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10138 f3b2605a-c512-4ea7… 
Jun 28 2013
df08f3e483fasjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10137 f3b2605a-c512-4ea7… 
Jun 28 2013
83f360b90bc9sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10136 f3b2605a-c512-4ea7… 
Jun 28 2013
c0acc33584aesjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10134 f3b2605a-c512-4ea7… 
Jun 28 2013
45f0fb457d36sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10133 f3b2605a-c512-4ea7… 
Jun 28 2013
cb90b71a13easjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10132 f3b2605a-c512-4ea7… 
Jun 28 2013
c0afb45368f7sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10131 f3b2605a-c512-4ea7… 
Jun 28 2013
440d38977984sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10130 f3b2605a-c512-4ea7… 
Jun 28 2013
71a19e3883cdsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10114 f3b2605a-c512-4ea7… 
Jun 27 2013
2dbe3f80a2e8sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10103 f3b2605a-c512-4ea7… 
Jun 27 2013
0e045500433fAxel Kohlmeyer
massive patch to flag non-numeric input 
Jun 23 2013
6ed180b82a7cAxel Kohlmeyer
import bugfix from rolf isele-holder 
Jun 19 2013
47ae056af096Axel Kohlmeyer
adjust fix tune/kspace for ICMS timer class 
Jun 12 2013
f14985a68306Axel Kohlmeyer
Merge remote branch 'lammps-ro/master' into lammps-icms 
Jun 11 2013
81e1af3934d8pscrozi
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10068 f3b2605a-c512-4ea7… 
Jun 11 2013
e240e15c4d5fAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Jun 9 2013
00fe31ddd407sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10052 f3b2605a-c512-4ea7… 
Jun 8 2013
eec6088ce751sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10051 f3b2605a-c512-4ea7… 
Jun 8 2013
c9710e0c20adAxel Kohlmeyer
Merge remote branch 'lammps-ro/master' into lammps-icms 
Jun 7 2013
af5a33fd1691sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10031 f3b2605a-c512-4ea7… 
Jun 6 2013
c33562cb7791Axel Kohlmeyer
Merge remote branch 'lammps-ro/master' into lammps-icms 
Jun 6 2013
849a767dc68bpscrozi
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10027 f3b2605a-c512-4ea7… 
Jun 5 2013
f68c9e83860aAxel Kohlmeyer
Merge remote branch 'lammps-ro/master' into lammps-icms 
Jun 5 2013
c886f137b01dsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10011 f3b2605a-c512-4ea7… 
Jun 4 2013
7f18289ee36esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10010 f3b2605a-c512-4ea7… 
Jun 4 2013
a6e871f0a523sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10009 f3b2605a-c512-4ea7… 
Jun 4 2013
88d49ad3e9cbAxel Kohlmeyer
more meaningful error location for numerical parsing checks 
Jun 4 2013
ce2b853e4a11Axel Kohlmeyer
Merge remote branch 'lammps-ro/master' into lammps-icms 
Jun 1 2013
d56c38d62d9csjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10008 f3b2605a-c512-4ea7… 
Jun 1 2013
124bfc5ba765sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9939 f3b2605a-c512-4ea7… 
May 30 2013
ea70c9719ccbAxel Kohlmeyer
make it compilable with win64 
May 17 2013
daa776a87d15Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
May 14 2013
e506467be5bepscrozi
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9878 f3b2605a-c512-4ea7… 
May 13 2013
3d7ee1825dc7Axel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
May 13 2013
c1b6654dbc9cAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
May 10 2013
6c5bf6c71a50pscrozi
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9857 f3b2605a-c512-4ea7… 
May 9 2013
07b41bfb6eb8sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9848 f3b2605a-c512-4ea7… 
May 8 2013
7018102f9f78sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9847 f3b2605a-c512-4ea7… 
May 8 2013
bfdbe3ab8764sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9846 f3b2605a-c512-4ea7… 
May 8 2013
86177f25e68bAxel Kohlmeyer
Merge remote branch 'lammps-ro/master' into lammps-icms 
Apr 30 2013
2cc636f1aa6cpscrozi
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9802 f3b2605a-c512-4ea7… 
Apr 29 2013
cb7e34af4102Axel Kohlmeyer
Merge remote branch 'lammps-ro/master' into lammps-icms 
Apr 26 2013
7903b2678702pscrozi
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9800 f3b2605a-c512-4ea7… 
Apr 25 2013
a289ce92d7a9sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9701 f3b2605a-c512-4ea7… 
Mar 21 2013
89120de84fd3Axel Kohlmeyer
initialization bugfix in pppm/disp 
Mar 19 2013
9b7c9b0d1e9aAxel Kohlmeyer
import long/disp updates from rolf 
Mar 19 2013
a3603ca40fcaAxel Kohlmeyer
Merge remote-tracking branch 'lammps-ro/master' into lammps-icms 
Mar 16 2013
040cedbe5aa1sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9687 f3b2605a-c512-4ea7… 
Mar 14 2013
0cd14bfb847asjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9658 f3b2605a-c512-4ea7… 
Mar 13 2013
21e4a32e6528Axel Kohlmeyer
Merge remote branch 'lammps-ro/master' into lammps-icms 
Mar 8 2013
1cdaba9662f5sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9619 f3b2605a-c512-4ea7… 
Mar 7 2013
c949b368e150sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9612 f3b2605a-c512-4ea7… 
Mar 7 2013
1dc3bee64c15sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9609 f3b2605a-c512-4ea7… 
Mar 7 2013
7f258bf917b0Axel Kohlmeyer
Merge remote branch 'lammps-ro/master' into lammps-icms 
Mar 7 2013
ed72c6c5ae87pscrozi
Optimizations to kspace_style MSM, including improving the single-core… 
Mar 6 2013
70fbc16e7da8sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9595 f3b2605a-c512-4ea7… 
Mar 6 2013
72c9d2d11f04sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9590 f3b2605a-c512-4ea7… 
Mar 6 2013
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