Homec4science
Diffusion lammps (lammm-master-deprecated) Graph

lammps/src/USER-OMP
lammm-master-deprecated

History Graph

CommitAuthorDetailsCommitted
47b02a0db346Axel Kohlmeyer
delete unused variable 
Jun 24 2012
aa6c10fa9433Axel Kohlmeyer
update fix qeq/comb with changes from upstream 
Jun 24 2012
a47ece862eeeAxel Kohlmeyer
update multi-threaded neighbor list code with new upstream modules. 
Jun 24 2012
de240b156546Axel Kohlmeyer
update to sync with upstream (fix rigid support) 
Jun 23 2012
f55e618e9e83sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8351 f3b2605a-c512-4ea7… 
Jun 20 2012
2dcc34728347Axel Kohlmeyer
update granular simulation related code in USER-OMP to upstream 
Jun 19 2012
466dab27e468sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8327 f3b2605a-c512-4ea7… 
Jun 19 2012
f33760eaaa2eAxel Kohlmeyer
delete unused variable 
Jun 15 2012
2b40b9c59b62Axel Kohlmeyer
include neighbor list bugfix into multi-threaded neighbor lists 
Jun 15 2012
4c4586421771sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8298 f3b2605a-c512-4ea7… 
Jun 15 2012
c8e641a72ddaAxel Kohlmeyer
more whitespace cleanup 
Jun 15 2012
2d454a09d269Axel Kohlmeyer
add multi-threaded versions of lj/cut/coul/long/tip4p 
Jun 15 2012
48aa45f7f072Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Jun 7 2012
ef9e70054573sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8226 f3b2605a-c512-4ea7… 
Jun 7 2012
6105d3ea20e3sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8221 f3b2605a-c512-4ea7… 
Jun 4 2012
b36b069f3d7dAxel Kohlmeyer
adjust code to match upstream changes 
Jun 3 2012
25e319f781aaAxel Kohlmeyer
Merge branch 'master' into lammps-icms 
Jun 2 2012
4990f2e53ddfsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8208 f3b2605a-c512-4ea7… 
Jun 1 2012
978a99e0981fsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8206 f3b2605a-c512-4ea7… 
Jun 1 2012
2c77342ed35esjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8204 f3b2605a-c512-4ea7… 
Jun 1 2012
2bd9c4379ce3Axel Kohlmeyer
first batch of power function fixes 
Jun 1 2012
0458896c0ab9Axel Kohlmeyer
proper string constant handling 
Jun 1 2012
001229ba62d9Axel Kohlmeyer
remove unused variables 
Jun 1 2012
c6a03521ef0eAxel Kohlmeyer
cleanup. sync with non-openmp version 
Jun 1 2012
dfae7ce41b15Axel Kohlmeyer
for multiplicity 0 ddf1 may be used unitialized => crash. 
Jun 1 2012
8819bb923c92Axel Kohlmeyer
remove unneeded variable 
Jun 1 2012
654b39a84163Axel Kohlmeyer
fix bug in computing 1-3 repulsion 
May 31 2012
d314704ec9edAxel Kohlmeyer
fix bug in cosine/shift angle potential energy calculation. 
May 31 2012
022c83b95fe2sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8192 f3b2605a-c512-4ea7… 
May 29 2012
824e0d321c17sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8191 f3b2605a-c512-4ea7… 
May 29 2012
bf675125470bAxel Kohlmeyer
add omp versions of newly added improper potentials 
May 28 2012
ebb8499f1a5aAxel Kohlmeyer
update FLD pair styles to the current status. 
May 28 2012
144f2f2fd6a8sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8159 f3b2605a-c512-4ea7… 
May 23 2012
a3bee6a98b19sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8156 f3b2605a-c512-4ea7… 
May 23 2012
b9a5be1c6cfbAxel Kohlmeyer
make sure cut_respa is initialized to NULL in derived classes that don't… 
May 12 2012
927a9a4c29b1Axel Kohlmeyer
apply optimizations based on suggestion from adian lange 
May 12 2012
d650aef0dfb7Axel Kohlmeyer
carry over mike brown's bugfix into /omp version. some formatting cleanup. 
May 11 2012
9a8709ecc46fAxel Kohlmeyer
drop const from all remaining templated parameters 
May 11 2012
b332797bb9f4Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
May 6 2012
9d3bba4ca834sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8047 f3b2605a-c512-4ea7… 
May 4 2012
58095ee7b480Axel Kohlmeyer
be safer from very small angle/dihedral terms in the bond order calculation 
Mar 29 2012
6c836ed0e4c1sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7924 f3b2605a-c512-4ea7… 
Mar 7 2012
9a2e4940b9dcAxel Kohlmeyer
more efficient per atom energy and virial support 
Mar 7 2012
61c4fa6ee0e0sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7907 f3b2605a-c512-4ea7… 
Mar 5 2012
893928fe7c66Axel Kohlmeyer
massive suffix cleanup, fix bug in bonded energy tally 
Mar 3 2012
b2ccacbdc010sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7883 f3b2605a-c512-4ea7… 
Mar 2 2012
4deb839d4b33sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7881 f3b2605a-c512-4ea7… 
Mar 2 2012
172f6724d9dfAxel Kohlmeyer
Merge branch 'master' into lammps-icms 
Mar 2 2012
70eae9b8ec8cAxel Kohlmeyer
enabled support for energy/atom and stress/atom. 
Mar 1 2012
b44f860f7072Axel Kohlmeyer
fix embarrassing bug in pppm/tip4p/omp. doc-update 
Mar 1 2012
cee8a7d3739bAxel Kohlmeyer
incorporate changes from upstream 
Mar 1 2012
3fb19bcea664sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7873 f3b2605a-c512-4ea7… 
Mar 1 2012
fa23c5c670caAxel Kohlmeyer
update tip4p styles to include upstream bugfix 
Mar 1 2012
90ce52e383b3Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Feb 29 2012
2e686fb6cadasjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7859 f3b2605a-c512-4ea7… 
Feb 28 2012
3450c008aa00sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7850 f3b2605a-c512-4ea7… 
Feb 28 2012
f83c6ea8e352Axel Kohlmeyer
add pppm/tip4p/omp kspace style. still buggy 
Feb 27 2012
282baa8a5c45Axel Kohlmeyer
make code more readable 
Feb 27 2012
a328a5a84690Axel Kohlmeyer
missing change 
Feb 17 2012
10d6ca2cca1aAxel Kohlmeyer
Merge branch 'master' into lammps-icms 
Feb 17 2012
7cad945d6172Axel Kohlmeyer
bugfix for Install.sh scripts. 
Feb 17 2012
b4bc9c69560bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7808 f3b2605a-c512-4ea7… 
Feb 16 2012
f55b74a85f70sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7804 f3b2605a-c512-4ea7… 
Feb 16 2012
0be192774732sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7793 f3b2605a-c512-4ea7… 
Feb 15 2012
dc679b390ac0Axel Kohlmeyer
fix bug in Pair::single() method and clean up coulomb energy calculation and… 
Feb 14 2012
75cc4b04cc17Axel Kohlmeyer
fix installation issues with manipulating Makefile.package 
Feb 11 2012
c15e56c6b05fAxel Kohlmeyer
add suffix support for missing files 
Feb 11 2012
86a4c5a70443Axel Kohlmeyer
reworked the identification of thread-aware pair styles. pressure from f dot r… 
Feb 11 2012
5b2c91ebf1acAxel Kohlmeyer
bugfix for virial calculation in hybrid pair styles 
Feb 11 2012
580905c81763Axel Kohlmeyer
multi-threaded meam/spline pair style 
Feb 4 2012
805690bfa98dAxel Kohlmeyer
multi-threaded beck pair style 
Feb 4 2012
416f52f28e6dAxel Kohlmeyer
fix race condition in derived neighborlist build 
Feb 4 2012
78e2b4b61da3Axel Kohlmeyer
minor corrections to install scripts. silence compiler warning 
Feb 3 2012
c3bd519b7860sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7673 f3b2605a-c512-4ea7… 
Feb 2 2012
6214cf294416Axel Kohlmeyer
Merge branch 'master' into lammps-icms 
Feb 2 2012
f884a7ec8574sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7647 f3b2605a-c512-4ea7… 
Feb 1 2012
2c42373bc8d0sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7644 f3b2605a-c512-4ea7… 
Feb 1 2012
0b2c652aa97dsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7641 f3b2605a-c512-4ea7… 
Feb 1 2012
31581265e3aaAxel Kohlmeyer
clean up looping constructs to remove useless tests. 
Feb 1 2012
ed6937789dd9Axel Kohlmeyer
implement thread safe error checking. 
Feb 1 2012
27760c3a4276Axel Kohlmeyer
add USER-CUDA compatibility 
Jan 31 2012
4df037aa3b0bAxel Kohlmeyer
use a namespace with static const to propagate fix flags safely. 
Jan 31 2012
b9591bc8db64Axel Kohlmeyer
make check for interaction list overflow tersoff/table/omp thread safe 
Jan 28 2012
4038fac58a92Axel Kohlmeyer
fix compile error 
Jan 27 2012
0eae9dd92762Axel Kohlmeyer
insert a test for too many local neighbors. 
Jan 27 2012
5f7e3909e7b8Axel Kohlmeyer
proper resize of nmax based arrays. 
Jan 26 2012
0fd19d9f0d9aAxel Kohlmeyer
merge in updated COMB potential from Tzu-Ray Shan 
Jan 26 2012
466427799a16Axel Kohlmeyer
multi-threaded versions of soon to come styles 
Jan 10 2012
4522aea17e08sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7523 f3b2605a-c512-4ea7… 
Jan 10 2012
f903234a46d3Axel Kohlmeyer
add lj/smooth/linear/omp, bugfix for serial version 
Jan 10 2012
456215e99718Axel Kohlmeyer
sync comb/omp with changes in plain comb 
Jan 10 2012
b4698a5a178dAxel Kohlmeyer
more neighbor list building changes 
Jan 9 2012
9e4fd659e9d6sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7466 f3b2605a-c512-4ea7… 
Jan 9 2012
c6195ddc07bdAxel Kohlmeyer
update neighborlist code according to upstream. 
Jan 9 2012
a10a77764004sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7437 f3b2605a-c512-4ea7… 
Jan 6 2012
b7110fa2a6c9Axel Kohlmeyer
we need to check for nvals, not nall. 
Jan 3 2012
82cf5261f976Axel Kohlmeyer
handle the case of more threads than atoms. 
Jan 2 2012
27e2bba2aa4bAxel Kohlmeyer
don't do double barriers 
Jan 2 2012
8b850d568082Axel Kohlmeyer
handle reduction for when nthreads > nall 
Jan 2 2012
28b32af3a4dfAxel Kohlmeyer
add multi-threaded version of pppm/cg 
Dec 28 2011
First
Prev
3
4
5
6
7
Next
c4science · Help