lammps

ewald.cpp

Changing variable name so that it isn't overloaded.

2012-07-05 21:57:29 +00:00

ewald.h

Making initial estimate for g_ewald more robust and better documented.

2012-06-29 22:25:31 +00:00

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@8226 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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

Install.sh

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8529 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-08-06 20:48:48 +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

msm.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8781 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-09-13 20:19:20 +00:00

msm.h

Adding MSM code.

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

pair_born_coul_long.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

pair_born_coul_long.h

Adding MSM code.

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

pair_born_coul_msm.cpp

Adding MSM code.

2012-09-13 20:01:47 +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@8226 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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

pair_buck_coul_long.h

Adding MSM code.

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

pair_buck_coul_msm.cpp

Adding MSM code.

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

pair_buck_coul_msm.h

Adding MSM code.

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

pair_coul_long.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

pair_coul_long.h

Adding MSM code.

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

pair_coul_msm.cpp

Adding MSM code.

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

pair_coul_msm.h

Adding MSM code.

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

pair_lj_charmm_coul_long.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

pair_lj_charmm_coul_long.h

Adding MSM code.

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

pair_lj_charmm_coul_msm.cpp

Adding MSM code.

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

pair_lj_charmm_coul_msm.h

Adding MSM code.

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

pair_lj_cut_coul_long_tip4p.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8498 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-07-25 15:16:20 +00:00

pair_lj_cut_coul_long_tip4p.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8439 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-06-29 21:10:14 +00:00

pair_lj_cut_coul_long.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8498 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-07-25 15:16:20 +00:00

pair_lj_cut_coul_long.h

Adding MSM code.

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

pair_lj_cut_coul_msm.cpp

Adding MSM code.

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

pair_lj_cut_coul_msm.h

Adding MSM code.

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

pppm_cg.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8530 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-08-06 21:05:10 +00:00

pppm_cg.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8530 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-08-06 21:05:10 +00:00

pppm_old.cpp

Updating timings tests in pppm_old.cpp/h to match those in pppm.cpp/h

2012-09-13 14:59:22 +00:00

pppm_old.h

Updating timings tests in pppm_old.cpp/h to match those in pppm.cpp/h

2012-09-13 14:59:22 +00:00

pppm_tip4p.cpp

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8530 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-08-06 21:05:10 +00:00

pppm_tip4p.h

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8530 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2012-08-06 21:05:10 +00:00

pppm.cpp

Adding missing semi-colon.

2012-09-11 18:22:16 +00:00

pppm.h

Adding changes to 2 FFT PPPM so that it runs faster in NPT mode. This is due to computing self-force pre-coeffs once that used to be computed after volume changes. These pre-coeffs are not dependent on box size/shape.

2012-09-10 23:10:31 +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