lammps

commgrid.cpp

Optimizations to kspace_style MSM, including improving the single-core performance and increasing the parallel scalability. A bug in MSM for mixed periodic and non-periodic boundary conditions was also fixed.

2013-03-06 21:12:28 +00:00

commgrid.h

Optimizations to kspace_style MSM, including improving the single-core performance and increasing the parallel scalability. A bug in MSM for mixed periodic and non-periodic boundary conditions was also fixed.

2013-03-06 21:12:28 +00:00

ewald_disp.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9848 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-05-08 21:12:15 +00:00

ewald_disp.h

Merge remote branch 'lammps-ro/master' into lammps-icms

2013-03-05 13:25:28 +01:00

ewald.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9848 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-05-08 21:12:15 +00:00

ewald.h

Merge remote-tracking branch 'lammps-ro/master' into lammps-icms

2013-05-10 10:03:21 +02:00

fft3d_wrap.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8226 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-06-06 22:47:51 +00:00

fft3d_wrap.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8679 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-08-17 13:26:41 +00:00

fft3d.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8226 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-06-06 22:47:51 +00:00

fft3d.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9085 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-11-21 16:11:12 +00:00

Install.sh

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9401 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-02-08 16:55:28 +00:00

kissfft.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8226 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-06-06 22:47:51 +00:00

math_complex.h

Merge branch 'master' into lammps-icms

2012-10-12 08:46:39 -04:00

math_vector.h

Merge branch 'master' into lammps-icms

2012-10-12 08:46:39 -04:00

msm_cg.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9847 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-05-08 21:08:55 +00:00

msm_cg.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9566 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-03-04 23:09:29 +00:00

msm.cpp

make it compilable with win64

2013-05-17 15:58:16 +02:00

msm.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9846 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-05-08 20:48:19 +00:00

pair_born_coul_long.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9056 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-11-12 21:12:26 +00:00

pair_born_coul_long.h

Merge remote branch 'lammps-ro/master' into lammps-icms

2013-03-05 13:25:28 +01:00

pair_born_coul_msm.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9878 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-05-13 17:17:58 +00:00

pair_born_coul_msm.h

Adding MSM code.

2012-09-13 20:01:47 +00:00

pair_buck_coul_long.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9567 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-03-05 00:00:50 +00:00

pair_buck_coul_long.h

Merge remote branch 'lammps-ro/master' into lammps-icms

2013-03-05 13:25:28 +01:00

pair_buck_coul_msm.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9878 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-05-13 17:17:58 +00:00

pair_buck_coul_msm.h

Adding MSM code.

2012-09-13 20:01:47 +00:00

pair_buck_long_coul_long.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9701 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-03-21 17:36:09 +00:00

pair_buck_long_coul_long.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9687 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-03-14 16:34:11 +00:00

pair_coul_long.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9056 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-11-12 21:12:26 +00:00

pair_coul_long.h

Merge remote branch 'lammps-ro/master' into lammps-icms

2013-03-05 13:25:28 +01:00

pair_coul_msm.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9878 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-05-13 17:17:58 +00:00

pair_coul_msm.h

Changes to coulomb tables.

2012-10-17 23:27:34 +00:00

pair_lj_charmm_coul_long.cpp

Changes to coulomb tables.

2012-10-17 23:27:34 +00:00

pair_lj_charmm_coul_long.h

Merge remote branch 'lammps-ro/master' into lammps-icms

2013-03-05 13:25:28 +01:00

pair_lj_charmm_coul_msm.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9878 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-05-13 17:17:58 +00:00

pair_lj_charmm_coul_msm.h

Changes to coulomb tables.

2012-10-17 23:27:34 +00:00

pair_lj_cut_coul_long.cpp

Changes to coulomb tables.

2012-10-17 23:27:34 +00:00

pair_lj_cut_coul_long.h

Merge remote branch 'lammps-ro/master' into lammps-icms

2013-03-05 13:25:28 +01:00

pair_lj_cut_coul_msm.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9857 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-05-09 20:28:47 +00:00

pair_lj_cut_coul_msm.h

Changes to coulomb tables.

2012-10-17 23:27:34 +00:00

pair_lj_cut_tip4p_long.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9619 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-03-07 22:06:44 +00:00

pair_lj_cut_tip4p_long.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9567 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-03-05 00:00:50 +00:00

pair_lj_long_coul_long.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9701 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-03-21 17:36:09 +00:00

pair_lj_long_coul_long.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9590 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-03-06 17:20:27 +00:00

pair_lj_long_tip4p_long.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9701 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-03-21 17:36:09 +00:00

pair_lj_long_tip4p_long.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9701 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-03-21 17:36:09 +00:00

pppm_cg.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9847 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-05-08 21:08:55 +00:00

pppm_cg.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9449 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-02-12 15:38:24 +00:00

pppm_disp_tip4p.cpp

Merge remote-tracking branch 'lammps-ro/master' into lammps-icms

2013-05-10 10:03:21 +02:00

pppm_disp_tip4p.h

Merge remote branch 'lammps-ro/master' into lammps-icms

2013-03-05 13:25:28 +01:00

pppm_disp.cpp

Merge remote-tracking branch 'lammps-ro/master' into lammps-icms

2013-05-10 10:03:21 +02:00

pppm_disp.h

Merge remote branch 'lammps-ro/master' into lammps-icms

2013-03-07 13:30:00 +01:00

pppm_old.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9847 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-05-08 21:08:55 +00:00

pppm_old.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9567 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-03-05 00:00:50 +00:00

pppm_tip4p.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9847 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-05-08 21:08:55 +00:00

pppm_tip4p.h

Merge branch 'master' into lammps-icms

2013-01-23 07:09:33 -05:00

pppm.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9848 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-05-08 21:12:15 +00:00

pppm.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9846 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2013-05-08 20:48:19 +00:00

remap_wrap.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8226 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-06-06 22:47:51 +00:00

remap_wrap.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8226 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-06-06 22:47:51 +00:00

remap.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8226 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-06-06 22:47:51 +00:00

remap.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8226 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-06-06 22:47:51 +00:00