Commit Graph

65 Commits

Author SHA1 Message Date
3295bdbec0 Merge branch 'openmp-next-merge' into openmp-master
Resolved Conflicts:
	doc/fix_wall_reflect.txt
	src/GPU/fix_gpu.cpp
	src/USER-CUDA/verlet_cuda.cpp
	src/min.cpp
	src/neigh_full.cpp
	src/neigh_request.cpp
	src/respa.cpp
2011-10-25 08:40:55 -04:00
c6bbdcfbf2 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7184 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-24 20:28:02 +00:00
31dc359e82 Merge branch 'master' into openmp-step6
Resolved Conflicts:
	src/GPU/pppm_gpu.cpp
	src/KSPACE/ewald.h
	src/MANYBODY/pair_airebo.cpp
	src/MANYBODY/pair_comb.cpp
	src/MANYBODY/pair_comb.h
	src/MANYBODY/pair_tersoff.h
	src/MOLECULE/pair_hbond_dreiding_lj.cpp
	src/MOLECULE/pair_hbond_dreiding_morse.cpp
	src/USER-CUDA/pppm_cuda.cpp
	src/USER-OMP/Install.sh
	src/USER-OMP/Package.sh
	src/USER-OMP/dihedral_charmm_omp.cpp
	src/USER-OMP/dihedral_charmm_omp.h
	src/USER-OMP/dihedral_class2_omp.cpp
	src/USER-OMP/dihedral_class2_omp.h
	src/USER-OMP/dihedral_cosine_shift_exp_omp.cpp
	src/USER-OMP/dihedral_cosine_shift_exp_omp.h
	src/USER-OMP/dihedral_harmonic_omp.cpp
	src/USER-OMP/dihedral_harmonic_omp.h
	src/USER-OMP/dihedral_helix_omp.cpp
	src/USER-OMP/dihedral_helix_omp.h
	src/USER-OMP/dihedral_multi_harmonic_omp.cpp
	src/USER-OMP/dihedral_multi_harmonic_omp.h
	src/USER-OMP/dihedral_opls_omp.cpp
	src/USER-OMP/dihedral_opls_omp.h
	src/USER-OMP/fix_nve_sphere_omp.cpp
	src/USER-OMP/pair_adp_omp.cpp
	src/USER-OMP/pair_adp_omp.h
	src/USER-OMP/pair_born_coul_long_omp.cpp
	src/USER-OMP/pair_born_coul_long_omp.h
	src/USER-OMP/pair_born_omp.cpp
	src/USER-OMP/pair_born_omp.h
	src/USER-OMP/pair_buck_coul_cut_omp.cpp
	src/USER-OMP/pair_buck_coul_cut_omp.h
	src/USER-OMP/pair_buck_coul_long_omp.cpp
	src/USER-OMP/pair_buck_coul_long_omp.h
	src/USER-OMP/pair_buck_coul_omp.cpp
	src/USER-OMP/pair_buck_coul_omp.h
	src/USER-OMP/pair_buck_omp.cpp
	src/USER-OMP/pair_buck_omp.h
	src/USER-OMP/pair_cdeam_omp.cpp
	src/USER-OMP/pair_cdeam_omp.h
	src/USER-OMP/pair_colloid_omp.cpp
	src/USER-OMP/pair_colloid_omp.h
	src/USER-OMP/pair_coul_cut_omp.cpp
	src/USER-OMP/pair_coul_cut_omp.h
	src/USER-OMP/pair_coul_debye_omp.cpp
	src/USER-OMP/pair_coul_debye_omp.h
	src/USER-OMP/pair_coul_long_omp.cpp
	src/USER-OMP/pair_coul_long_omp.h
	src/USER-OMP/pair_dipole_cut_omp.cpp
	src/USER-OMP/pair_dipole_cut_omp.h
	src/USER-OMP/pair_dipole_sf_omp.cpp
	src/USER-OMP/pair_dipole_sf_omp.h
	src/USER-OMP/pair_dpd_omp.cpp
	src/USER-OMP/pair_dpd_omp.h
	src/USER-OMP/pair_dpd_tstat_omp.cpp
	src/USER-OMP/pair_dpd_tstat_omp.h
	src/USER-OMP/pair_eam_omp.cpp
	src/USER-OMP/pair_eam_omp.h
	src/USER-OMP/pair_edip_omp.cpp
	src/USER-OMP/pair_edip_omp.h
	src/USER-OMP/pair_eim_omp.cpp
	src/USER-OMP/pair_eim_omp.h
	src/USER-OMP/pair_gauss_omp.cpp
	src/USER-OMP/pair_gauss_omp.h
	src/USER-OMP/pair_gayberne_omp.cpp
	src/USER-OMP/pair_gayberne_omp.h
	src/USER-OMP/pair_gran_hertz_history_omp.cpp
	src/USER-OMP/pair_gran_hertz_history_omp.h
	src/USER-OMP/pair_gran_hooke_history_omp.cpp
	src/USER-OMP/pair_gran_hooke_history_omp.h
	src/USER-OMP/pair_gran_hooke_omp.cpp
	src/USER-OMP/pair_gran_hooke_omp.h
	src/USER-OMP/pair_hbond_dreiding_lj_omp.cpp
	src/USER-OMP/pair_hbond_dreiding_lj_omp.h
	src/USER-OMP/pair_hbond_dreiding_morse_omp.cpp
	src/USER-OMP/pair_hbond_dreiding_morse_omp.h
	src/USER-OMP/pair_lj96_cut_omp.cpp
	src/USER-OMP/pair_lj96_cut_omp.h
	src/USER-OMP/pair_lj_charmm_coul_charmm_implicit_omp.cpp
	src/USER-OMP/pair_lj_charmm_coul_charmm_implicit_omp.h
	src/USER-OMP/pair_lj_charmm_coul_charmm_omp.cpp
	src/USER-OMP/pair_lj_charmm_coul_charmm_omp.h
	src/USER-OMP/pair_lj_charmm_coul_long_omp.cpp
	src/USER-OMP/pair_lj_charmm_coul_long_omp.h
	src/USER-OMP/pair_lj_class2_coul_cut_omp.cpp
	src/USER-OMP/pair_lj_class2_coul_cut_omp.h
	src/USER-OMP/pair_lj_class2_coul_long_omp.cpp
	src/USER-OMP/pair_lj_class2_coul_long_omp.h
	src/USER-OMP/pair_lj_class2_omp.cpp
	src/USER-OMP/pair_lj_class2_omp.h
	src/USER-OMP/pair_lj_coul_omp.cpp
	src/USER-OMP/pair_lj_coul_omp.h
	src/USER-OMP/pair_lj_cubic_omp.cpp
	src/USER-OMP/pair_lj_cubic_omp.h
	src/USER-OMP/pair_lj_cut_coul_cut_omp.cpp
	src/USER-OMP/pair_lj_cut_coul_cut_omp.h
	src/USER-OMP/pair_lj_cut_coul_debye_omp.cpp
	src/USER-OMP/pair_lj_cut_coul_debye_omp.h
	src/USER-OMP/pair_lj_cut_coul_long_omp.cpp
	src/USER-OMP/pair_lj_cut_coul_long_omp.h
	src/USER-OMP/pair_lj_cut_coul_long_tip4p_omp.cpp
	src/USER-OMP/pair_lj_cut_coul_long_tip4p_omp.h
	src/USER-OMP/pair_lj_cut_omp.cpp
	src/USER-OMP/pair_lj_expand_omp.cpp
	src/USER-OMP/pair_lj_expand_omp.h
	src/USER-OMP/pair_lj_gromacs_coul_gromacs_omp.cpp
	src/USER-OMP/pair_lj_gromacs_coul_gromacs_omp.h
	src/USER-OMP/pair_lj_gromacs_omp.cpp
	src/USER-OMP/pair_lj_gromacs_omp.h
	src/USER-OMP/pair_lj_sf_omp.cpp
	src/USER-OMP/pair_lj_sf_omp.h
	src/USER-OMP/pair_lj_smooth_omp.cpp
	src/USER-OMP/pair_lj_smooth_omp.h
	src/USER-OMP/pair_lubricate_omp.cpp
	src/USER-OMP/pair_lubricate_omp.h
	src/USER-OMP/pair_morse_omp.cpp
	src/USER-OMP/pair_morse_omp.h
	src/USER-OMP/pair_peri_lps_omp.cpp
	src/USER-OMP/pair_peri_lps_omp.h
	src/USER-OMP/pair_peri_pmb_omp.cpp
	src/USER-OMP/pair_peri_pmb_omp.h
	src/USER-OMP/pair_resquared_omp.cpp
	src/USER-OMP/pair_resquared_omp.h
	src/USER-OMP/pair_soft_omp.cpp
	src/USER-OMP/pair_soft_omp.h
	src/USER-OMP/pair_sw_omp.cpp
	src/USER-OMP/pair_sw_omp.h
	src/USER-OMP/pair_table_omp.cpp
	src/USER-OMP/pair_table_omp.h
	src/USER-OMP/pair_tersoff_omp.cpp
	src/USER-OMP/pair_tersoff_omp.h
	src/USER-OMP/pair_yukawa_colloid_omp.cpp
	src/USER-OMP/pair_yukawa_colloid_omp.h
	src/USER-OMP/pair_yukawa_omp.cpp
	src/USER-OMP/pair_yukawa_omp.h
	src/USER-OMP/thr_omp.cpp
	src/USER-OMP/thr_omp.h
	src/read_data.cpp
2011-10-21 15:50:39 -04:00
f1b4f88d27 support suffix handling for kspace styles 2011-10-18 01:46:33 -04:00
c1bfbd8e61 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7057 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-10 14:58:50 +00:00
af967c6070 create fix omp instance with package omp command 2011-10-09 19:54:17 -04:00
15203cb792 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7039 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-06 17:55:48 +00:00
e23e68a509 expand suffix handling in input processing 2011-10-03 22:18:18 -04:00
19e8c92a90 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7003 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-09-23 18:06:55 +00:00
1490fa2606 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6759 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-08-23 15:25:59 +00:00
b416be6cbc git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6710 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-08-17 21:37:24 +00:00
ba299cf0eb git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6700 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-08-17 14:24:44 +00:00
aedbb28b6c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6486 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-06-30 20:10:18 +00:00
c76fd4256e git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6315 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-06-07 17:14:35 +00:00
d9824c7583 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6305 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-06-07 15:25:20 +00:00
1f19be90b8 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6287 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-06-01 17:34:26 +00:00
5bf395f4d7 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6263 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-05-31 22:36:53 +00:00
ab5592e67b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6221 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-05-26 22:45:42 +00:00
0ca2e3b389 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6217 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-05-26 22:00:16 +00:00
e97e40698a git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6209 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-05-23 14:04:44 +00:00
ad89319d7c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6201 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-05-20 23:39:34 +00:00
3ae193256b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6196 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-05-20 22:59:15 +00:00
e5693fb5db git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6180 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-05-20 16:16:48 +00:00
ae07e039c5 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6157 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-05-20 15:53:02 +00:00
819524ebd6 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5932 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-04-13 21:40:14 +00:00
1f2a7add78 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5836 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-03-26 00:50:29 +00:00
bad635f636 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5745 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-03-07 21:52:28 +00:00
89cbe1ceeb git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5591 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-02-04 19:13:14 +00:00
bcaa5adb67 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5345 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2010-12-01 00:12:51 +00:00
5d66783527 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5343 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2010-12-01 00:01:42 +00:00
03869e4781 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5336 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2010-11-29 17:57:09 +00:00
31e65b4e72 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5258 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2010-11-18 17:28:47 +00:00
460379ce20 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5250 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2010-11-17 18:25:24 +00:00
b57959fe8a git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4867 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2010-09-27 17:33:53 +00:00
5b6e639485 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4748 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2010-09-09 00:01:34 +00:00
27e8888127 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4433 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2010-08-04 15:10:00 +00:00
841a27b442 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4163 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2010-05-20 15:53:39 +00:00
c25a8ad426 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3743 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2010-01-23 23:20:49 +00:00
46a7dc9db8 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3734 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2010-01-20 15:12:36 +00:00
fae7fd7621 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3730 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2010-01-19 17:56:46 +00:00
1dbad849b7 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3674 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2010-01-13 20:55:06 +00:00
2c643b7dc5 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3655 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2010-01-12 01:37:48 +00:00
0cc1d090f4 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2330 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-01-05 22:26:08 +00:00
71fbecea76 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2286 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2008-12-04 19:47:29 +00:00
e520a220a3 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1840 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2008-05-16 21:58:06 +00:00
fada174882 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1279 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2008-01-03 18:57:32 +00:00
b2e9f7dc10 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1272 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2008-01-02 19:24:46 +00:00
a5eda24459 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1249 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2007-12-13 14:33:56 +00:00
9c1c10e1c4 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1091 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2007-10-22 23:26:34 +00:00
5c09d455db git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@778 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2007-08-07 13:13:03 +00:00