Homec4science
Diffusion lammps (lammps-icms) Graph

Graph
lammps-icms

History Graph

CommitAuthorDetailsCommitted
9fb8cfa0e855Axel Kohlmeyer
add reference runs for NSF machines. 
Nov 23 2010
01e8c6564883Axel Kohlmeyer
import makefiles for compiling on NCSA lincoln/abe 
Nov 23 2010
8b146a9a99c0Axel Kohlmeyer
GPU ECC flag support only available with cuda 3.1+ 
Nov 21 2010
1e288ec61a43Axel Kohlmeyer
another missed Pair::extract() API change bugfix. 
Nov 21 2010
f16b490abedfAxel Kohlmeyer
fix stupid idea to use $SHELL as shell override. 
Nov 20 2010
81df7fc57f78Axel Kohlmeyer
more compile flag tuning for longhorn. 
Nov 20 2010
cfea9c6bf355Axel Kohlmeyer
tune host compiler flags for longhorn 
Nov 20 2010
1a5d3322d41dAxel Kohlmeyer
default to mixed precision compile 
Nov 20 2010
cd166c6f2f0aAxel Kohlmeyer
integrate vmd wrapper module for pizza.py 
Nov 20 2010
dd247a869aa0Axel Kohlmeyer
restart2data support for gpu accelerated styles 
Nov 20 2010
436dfcf7353eAxel Kohlmeyer
include string.h for strcmp(). 
Nov 19 2010
6f07eac1d674Axel Kohlmeyer
a few more changes to make the OMP proxies go away. 
Nov 19 2010
a077bd358879Axel Kohlmeyer
add change missed in previous commit. 
Nov 19 2010
880464655805Axel Kohlmeyer
no need to have proxies just add friends. 
Nov 19 2010
b90adda6fa2eAxel Kohlmeyer
use per-thread storage for accumulators in OpenMP. 
Nov 19 2010
6c53f28b94aeAxel Kohlmeyer
two more dihedral coeff() API updates. 
Nov 19 2010
849a56342ac2Axel Kohlmeyer
fix error in conditional file update check. 
Nov 19 2010
bb739a67e95fAxel Kohlmeyer
adjust dihedral classes to match new coeff API. 
Nov 19 2010
41c9f10d0746Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Nov 19 2010
03dfe53a210fsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5265 f3b2605a-c512-4ea7… 
Nov 18 2010
b6444e36cde5Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Nov 18 2010
7b842d7f453esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5264 f3b2605a-c512-4ea7… 
Nov 18 2010
1238f8b68c44sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5263 f3b2605a-c512-4ea7… 
Nov 18 2010
fed74f2e9826sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5262 f3b2605a-c512-4ea7… 
Nov 18 2010
4eb25924b0c2sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5261 f3b2605a-c512-4ea7… 
Nov 18 2010
503d2df41d76sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5259 f3b2605a-c512-4ea7… 
Nov 18 2010
31e65b4e72e0sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5258 f3b2605a-c512-4ea7… 
Nov 18 2010
37b51e682fa0sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5257 f3b2605a-c512-4ea7… 
Nov 18 2010
61dcd4156e86sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5255 f3b2605a-c512-4ea7… 
Nov 18 2010
db112d8bb739Axel Kohlmeyer
add "fix gpu" documentation. 
Nov 18 2010
3246bc8c924dAxel Kohlmeyer
aggressive optimization for fermi machine. 
Nov 18 2010
88b4e8a062b1Axel Kohlmeyer
delete references to still unused MSM code. 
Nov 18 2010
b6a5b9d703d4Axel Kohlmeyer
remove references to MSM (for now). 
Nov 18 2010
5087fc961783Axel Kohlmeyer
we track gpulammps status in the README file now. 
Nov 18 2010
f324ce503e56Axel Kohlmeyer
updates to the README to match current status. 
Nov 18 2010
2c7c8198fe88Axel Kohlmeyer
compile mixed precision and sm_20 now. 
Nov 18 2010
233de1db5d26Axel Kohlmeyer
add note saying this is a modified source. 
Nov 18 2010
4a5457759d36Axel Kohlmeyer
regenerate files. 
Nov 18 2010
547b9b612233Axel Kohlmeyer
import documentation updates for the GPU package. 
Nov 18 2010
29006811dcd9athomps
Fix problems with restarts and non-existent types 
Nov 18 2010
bea8feec9052sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5252 f3b2605a-c512-4ea7… 
Nov 17 2010
c5c8dbbf3fb9sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5251 f3b2605a-c512-4ea7… 
Nov 17 2010
460379ce2003sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5250 f3b2605a-c512-4ea7… 
Nov 17 2010
63b85bd717a3sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5249 f3b2605a-c512-4ea7… 
Nov 17 2010
5c92d3a7ac96sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5248 f3b2605a-c512-4ea7… 
Nov 17 2010
7ccbc7e75b37sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5247 f3b2605a-c512-4ea7… 
Nov 17 2010
9c67065bb96esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5246 f3b2605a-c512-4ea7… 
Nov 17 2010
dcac65bc15eaAxel Kohlmeyer
bugfix for restarting reax/c runs 
Nov 15 2010
827a336fc633Axel Kohlmeyer
ignore reax/c package files in src 
Nov 15 2010
580585337890Axel Kohlmeyer
add newline at end of file. 
Nov 14 2010
29f336e0ddd9Axel Kohlmeyer
remove comment in comment. 
Nov 14 2010
30438cb7b305athomps
Document how to set unused parameters to zero 
Nov 13 2010
fd6c22a70f02athomps
Set unused parameters to zero 
Nov 13 2010
7885412f9ffeAxel Kohlmeyer
update GPU package support for r561 from svn. 
Nov 12 2010
1640f6b098f6Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Nov 12 2010
81cd9eb6fa26Axel Kohlmeyer
we need the full path to nvcc on shampoo. 
Nov 12 2010
733eb154db16athomps
Tweaked TATB output 
Nov 12 2010
b4150d11dc26Axel Kohlmeyer
sync to upstream revision 549. 
Nov 11 2010
db9844a8ffbdAxel Kohlmeyer
update makefile adjustments from upstream. 
Nov 11 2010
60377b6a21cbAxel Kohlmeyer
accumulate memory usage in double also for GB. 
Nov 11 2010
113dffba0ba4Axel Kohlmeyer
import upstream bugfix for pre-3.2 cuda compile 
Nov 11 2010
ad38e33fb300Axel Kohlmeyer
ensure all files from GPU package are uninstalled 
Nov 11 2010
aa083afca130Axel Kohlmeyer
configuration for shampoo@ICMS 
Nov 11 2010
05d2d20429cbAxel Kohlmeyer
remove pointless change 
Nov 11 2010
92cd2a69bf2dAxel Kohlmeyer
do GPU device memory accounting with doubles 
Nov 11 2010
92444042fcd3Axel Kohlmeyer
add missing header dependency. 
Nov 11 2010
d27edaf367ecAxel Kohlmeyer
enable gcc warnings 
Nov 11 2010
5ad9bfe32c59sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5236 f3b2605a-c512-4ea7… 
Nov 11 2010
5f35c38599edsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5235 f3b2605a-c512-4ea7… 
Nov 11 2010
b1918d47632asjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5234 f3b2605a-c512-4ea7… 
Nov 11 2010
71a6b77ea8c4sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5233 f3b2605a-c512-4ea7… 
Nov 10 2010
44b5e9b49660sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5232 f3b2605a-c512-4ea7… 
Nov 10 2010
f27a73ad68b9sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5231 f3b2605a-c512-4ea7… 
Nov 10 2010
630a307ae761Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Nov 9 2010
ee5f450c127dAxel Kohlmeyer
update gpu library to r539 
Nov 9 2010
638e3ca1a771Axel Kohlmeyer
adjust Pair::extract() API to match mainline code. 
Nov 8 2010
6fd8e9ac9e21Axel Kohlmeyer
update makefile configuration for GPU support 
Nov 8 2010
3251f1382c3cAxel Kohlmeyer
fix file broken by unresolved merge. 
Nov 8 2010
86bd2b29f250sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5230 f3b2605a-c512-4ea7… 
Nov 8 2010
140780bcd6e4sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5229 f3b2605a-c512-4ea7… 
Nov 8 2010
40ea8e4d340fathomps
Added potential gradient columns 
Nov 8 2010
423efabf0288Axel Kohlmeyer
updated GPU package from gpulammps project repo. 
Nov 8 2010
ba5fb80d1d4bAxel Kohlmeyer
merge of GPU library from gpulammps project. 
Nov 7 2010
ef7a99e48720Axel Kohlmeyer
shell portability updates to package management 
Nov 7 2010
605509ba56f8Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Nov 6 2010
f9c3f5b405a5athomps
Added potential gradient columns 
Nov 6 2010
80468a281f78athomps
Added potential gradient columns 
Nov 6 2010
6813e71251a2athomps
Added potential gradient columns 
Nov 6 2010
fb51a67f64a5athomps
Added potential gradient columns 
Nov 6 2010
0128dca0c5deathomps
Added potential gradient columns 
Nov 6 2010
6a22fc774824sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5220 f3b2605a-c512-4ea7… 
Nov 5 2010
c42726b8e3ddsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5218 f3b2605a-c512-4ea7… 
Nov 5 2010
b511a7557563sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5217 f3b2605a-c512-4ea7… 
Nov 5 2010
236cf5832809sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5216 f3b2605a-c512-4ea7… 
Nov 5 2010
5f916ccb7932Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Nov 5 2010
118a6d405c6cAxel Kohlmeyer
update customized sources to match new extract() 
Nov 4 2010
c2ac3c93c316Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Nov 4 2010
60a5ec92ac11Axel Kohlmeyer
remove executable file permissions where useless. 
Nov 4 2010
29170b0c8fb5Axel Kohlmeyer
add wrapper for MPI_Get_processor_name() to STUBS 
Nov 4 2010
850dc7782b72sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5215 f3b2605a-c512-4ea7… 
Nov 4 2010
1
2
Next
c4science · Help