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0d4bb8618325021a263f8705b3a8dcd4a443eee2
lammps/src/KSPACE
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Stan Moore 7a33d1e328 Code cleanup
2019-06-12 11:36:42 -06:00
..
ewald_dipole_spin.cpp
Code cleanup
2019-06-12 11:36:42 -06:00
ewald_dipole_spin.h
Merge branch 'clean-master2' of github.com:julient31/lammps into pppm_spin
2019-05-14 17:41:58 -06:00
ewald_dipole.cpp
Per-atom virial is not yet supported with pppm/dipole
2019-05-21 10:16:13 -06:00
ewald_dipole.h
Merge branch 'clean-master2' of github.com:julient31/lammps into pppm_spin
2019-05-14 17:41:58 -06:00
ewald_disp.cpp
use ev_init for kspace
2019-03-13 17:55:30 +01:00
ewald_disp.h
port documentation spelling fixes to comments or strings in source code.
2018-11-19 16:15:24 -05:00
ewald.cpp
use ev_init for kspace
2019-03-13 17:55:30 +01:00
ewald.h
port documentation spelling fixes to comments or strings in source code.
2018-11-19 16:15:24 -05:00
fft3d_wrap.cpp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14220 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-10-30 20:04:06 +00:00
fft3d_wrap.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11633 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-03-14 22:28:09 +00:00
fft3d.cpp
drop FFTW2 support, and change doc pages
2018-08-15 13:54:37 -06:00
fft3d.h
drop FFTW2 support, and change doc pages
2018-08-15 13:54:37 -06:00
fix_tune_kspace.cpp
protect against possible buffer overflow
2019-04-04 16:51:37 -04:00
fix_tune_kspace.h
replace C-style include files with their C++ equivalents
2018-04-27 18:00:24 -04:00
gridcomm.cpp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14220 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-10-30 20:04:06 +00:00
gridcomm.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12814 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-12-02 02:15:39 +00:00
kissfft.h
more changes to doc pages and CMakeLists.txt
2018-08-14 15:44:25 -06:00
msm_cg.cpp
use ev_init for kspace
2019-03-13 17:55:30 +01:00
msm_cg.h
kspace refactor compiles for KSPACE and USER-OMP
2018-10-19 15:11:37 -04:00
msm.cpp
use ev_init for kspace
2019-03-13 17:55:30 +01:00
msm.h
propagate the kspace change to a the first few kspace styles
2018-10-18 16:31:17 -04:00
pair_born_coul_long.cpp
use ev_unset for all pair styles
2019-03-13 17:49:16 +01:00
pair_born_coul_long.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12641 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-10-21 17:09:24 +00:00
pair_born_coul_msm.cpp
use ev_unset for all pair styles
2019-03-13 17:49:16 +01:00
pair_born_coul_msm.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13278 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-03-23 23:30:50 +00:00
pair_buck_coul_long.cpp
Merge pull request #1374 from akohlmey/collected-small-fixes
2019-03-25 13:15:45 -04:00
pair_buck_coul_long.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13303 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-03-27 13:41:29 +00:00
pair_buck_coul_msm.cpp
use ev_unset for all pair styles
2019-03-13 17:49:16 +01:00
pair_buck_coul_msm.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13278 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-03-23 23:30:50 +00:00
pair_buck_long_coul_long.cpp
use ev_unset for all pair styles
2019-03-13 17:49:16 +01:00
pair_buck_long_coul_long.h
add placeholders to include files for error messges
2018-04-03 17:48:31 -06:00
pair_coul_long.cpp
Merge pull request #1374 from akohlmey/collected-small-fixes
2019-03-25 13:15:45 -04:00
pair_coul_long.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13303 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-03-27 13:41:29 +00:00
pair_coul_msm.cpp
use ev_unset for all pair styles
2019-03-13 17:49:16 +01:00
pair_coul_msm.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13278 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-03-23 23:30:50 +00:00
pair_lj_charmm_coul_long.cpp
Merge pull request #1374 from akohlmey/collected-small-fixes
2019-03-25 13:15:45 -04:00
pair_lj_charmm_coul_long.h
more changes to rRESPA neighbor lists
2017-10-17 17:33:01 -06:00
pair_lj_charmm_coul_msm.cpp
use ev_unset for all pair styles
2019-03-13 17:49:16 +01:00
pair_lj_charmm_coul_msm.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13278 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-03-23 23:30:50 +00:00
pair_lj_charmmfsw_coul_long.cpp
make sure r3inv is initialized when lj and coul cutoff are different
2019-04-27 14:51:37 -04:00
pair_lj_charmmfsw_coul_long.h
more whitespace cleanup
2018-03-15 22:02:02 -04:00
pair_lj_cut_coul_long.cpp
use ev_unset for all pair styles
2019-03-13 17:49:16 +01:00
pair_lj_cut_coul_long.h
more changes to rRESPA neighbor lists
2017-10-17 17:33:01 -06:00
pair_lj_cut_coul_msm.cpp
use ev_unset for all pair styles
2019-03-13 17:49:16 +01:00
pair_lj_cut_coul_msm.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13278 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-03-23 23:30:50 +00:00
pair_lj_cut_tip4p_long.cpp
use ev_unset for all pair styles
2019-03-13 17:49:16 +01:00
pair_lj_cut_tip4p_long.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12641 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-10-21 17:09:24 +00:00
pair_lj_long_coul_long.cpp
use ev_unset for all pair styles
2019-03-13 17:49:16 +01:00
pair_lj_long_coul_long.h
add placeholders to include files for error messges
2018-04-03 17:48:31 -06:00
pair_lj_long_tip4p_long.cpp
use ev_unset for all pair styles
2019-03-13 17:49:16 +01:00
pair_lj_long_tip4p_long.h
remove executable permissions on non-executables and non-scripts
2016-09-08 14:45:07 -04:00
pair_tip4p_long.cpp
use ev_unset for all pair styles
2019-03-13 17:49:16 +01:00
pair_tip4p_long.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12641 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-10-21 17:09:24 +00:00
pppm_cg.cpp
use ev_init for kspace
2019-03-13 17:55:30 +01:00
pppm_cg.h
kspace refactor compiles for KSPACE and USER-OMP
2018-10-19 15:11:37 -04:00
pppm_dipole_spin.cpp
Code cleanup
2019-06-12 11:36:42 -06:00
pppm_dipole_spin.h
Per-atom virial is not yet supported with pppm/dipole
2019-05-21 10:16:13 -06:00
pppm_dipole.cpp
Add missing character
2019-05-21 10:30:33 -06:00
pppm_dipole.h
Per-atom virial is not yet supported with pppm/dipole
2019-05-21 10:16:13 -06:00
pppm_disp_tip4p.cpp
kspace refactor compiles for KSPACE and USER-OMP
2018-10-19 15:11:37 -04:00
pppm_disp_tip4p.h
kspace refactor compiles for KSPACE and USER-OMP
2018-10-19 15:11:37 -04:00
pppm_disp.cpp
use ev_init for kspace
2019-03-13 17:55:30 +01:00
pppm_disp.h
port spell fixes to source code
2018-11-20 00:09:11 -05:00
pppm_stagger.cpp
use ev_init for kspace
2019-03-13 17:55:30 +01:00
pppm_stagger.h
kspace refactor compiles for KSPACE and USER-OMP
2018-10-19 15:11:37 -04:00
pppm_tip4p.cpp
kspace refactor compiles for KSPACE and USER-OMP
2018-10-19 15:11:37 -04:00
pppm_tip4p.h
kspace refactor compiles for KSPACE and USER-OMP
2018-10-19 15:11:37 -04:00
pppm.cpp
Merge branch 'clean-master2' of github.com:julient31/lammps into pppm_spin
2019-04-19 15:02:25 -06:00
pppm.h
Merge branch 'clean-master2' of github.com:julient31/lammps into pppm_spin
2019-04-19 15:02:25 -06:00
remap_wrap.cpp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14220 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-10-30 20:04:06 +00:00
remap_wrap.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11633 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-03-14 22:28:09 +00:00
remap.cpp
Fix unused params in packages (#1076)
2018-08-24 10:42:08 -06:00
remap.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11633 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-03-14 22:28:09 +00:00