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d54384dd91efac1a6aa756d4e8220a6852cc8b71
lammps/src/USER-OMP
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Joel Clemmer d54384dd91 Merge branch 'master' into multi_epcc
2021-04-07 16:34:01 -06:00
..
angle_charmm_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
angle_charmm_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
angle_class2_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
angle_class2_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
angle_cosine_delta_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
angle_cosine_delta_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
angle_cosine_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
angle_cosine_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
angle_cosine_periodic_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
angle_cosine_periodic_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
angle_cosine_shift_exp_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
angle_cosine_shift_exp_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
angle_cosine_shift_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
angle_cosine_shift_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
angle_cosine_squared_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
angle_cosine_squared_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
angle_dipole_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
angle_dipole_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
angle_fourier_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
angle_fourier_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9404 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 16:57:12 +00:00
angle_fourier_simple_omp.cpp
more code formatting consistency changes for loops and conditionals
2020-12-30 09:47:45 -05:00
angle_fourier_simple_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9404 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 16:57:12 +00:00
angle_harmonic_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
angle_harmonic_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
angle_quartic_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
angle_quartic_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9404 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 16:57:12 +00:00
angle_sdk_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
angle_sdk_omp.h
remove cg/cmm style name aliases
2017-04-26 17:24:25 -04:00
angle_table_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
angle_table_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
bond_class2_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
bond_class2_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
bond_fene_expand_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
bond_fene_expand_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
bond_fene_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
bond_fene_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
bond_gromos_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
bond_gromos_omp.h
add gromos bond style
2017-10-16 14:57:12 -04:00
bond_harmonic_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
bond_harmonic_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
bond_harmonic_shift_cut_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
bond_harmonic_shift_cut_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
bond_harmonic_shift_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
bond_harmonic_shift_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
bond_morse_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
bond_morse_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
bond_nonlinear_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
bond_nonlinear_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
bond_quartic_omp.cpp
Replace a few more 2s with VIRIAL_FDOTR
2020-11-16 16:36:06 -05:00
bond_quartic_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
bond_table_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
bond_table_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
dihedral_charmm_omp.cpp
Replace a few more 2s with VIRIAL_FDOTR
2020-11-16 16:36:06 -05:00
dihedral_charmm_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
dihedral_class2_omp.cpp
fix bug not ported to USER-OMP version and adapt code style
2021-02-24 20:18:02 -05:00
dihedral_class2_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
dihedral_cosine_shift_exp_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
dihedral_cosine_shift_exp_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
dihedral_fourier_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
dihedral_fourier_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9404 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 16:57:12 +00:00
dihedral_harmonic_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
dihedral_harmonic_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
dihedral_helix_omp.cpp
fix a few more issues in USER-OMP and update indentation
2021-02-24 20:45:07 -05:00
dihedral_helix_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
dihedral_multi_harmonic_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
dihedral_multi_harmonic_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
dihedral_nharmonic_omp.cpp
correctly handle the case of n=1. clean up some ugliness
2021-02-24 18:37:39 -05:00
dihedral_nharmonic_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9404 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 16:57:12 +00:00
dihedral_opls_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
dihedral_opls_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
dihedral_quadratic_omp.cpp
Fix invalid result when dihedral quadratic angle is > pi or < -pi
2020-12-01 09:21:12 +01:00
dihedral_quadratic_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9404 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 16:57:12 +00:00
dihedral_table_omp.cpp
more consistent formatting of for/while loops and if statements
2020-12-30 09:09:08 -05:00
dihedral_table_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
domain_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
ewald_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
ewald_omp.h
add triclinic support to ewald/omp
2020-08-07 11:11:52 -04:00
fix_gravity_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
fix_gravity_omp.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
fix_neigh_history_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
fix_neigh_history_omp.h
updated neighbor list history processing for USER-OMP
2017-10-23 14:12:19 -04:00
fix_nh_asphere_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
fix_nh_asphere_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9408 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 17:12:37 +00:00
fix_nh_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
fix_nh_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9408 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 17:12:37 +00:00
fix_nh_sphere_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
fix_nh_sphere_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9408 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 17:12:37 +00:00
fix_nph_asphere_omp.cpp
simplify by using utils::strdup() and reorder includes
2021-03-28 22:22:13 -04:00
fix_nph_asphere_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9408 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 17:12:37 +00:00
fix_nph_omp.cpp
simplify by using utils::strdup() and reorder includes
2021-03-28 22:22:13 -04:00
fix_nph_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9408 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 17:12:37 +00:00
fix_nph_sphere_omp.cpp
simplify by using utils::strdup() and reorder includes
2021-03-28 22:22:13 -04:00
fix_nph_sphere_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9408 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 17:12:37 +00:00
fix_npt_asphere_omp.cpp
simplify by using utils::strdup() and reorder includes
2021-03-28 22:22:13 -04:00
fix_npt_asphere_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9408 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 17:12:37 +00:00
fix_npt_omp.cpp
simplify by using utils::strdup() and reorder includes
2021-03-28 22:22:13 -04:00
fix_npt_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9408 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 17:12:37 +00:00
fix_npt_sphere_omp.cpp
simplify by using utils::strdup() and reorder includes
2021-03-28 22:22:13 -04:00
fix_npt_sphere_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9408 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 17:12:37 +00:00
fix_nve_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
fix_nve_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9408 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 17:12:37 +00:00
fix_nve_sphere_omp.cpp
remove use of math_vector.h from /sphere integrator fixes
2021-01-15 16:55:23 -05:00
fix_nve_sphere_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9407 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 17:12:30 +00:00
fix_nvt_asphere_omp.cpp
simplify by using utils::strdup() and reorder includes
2021-03-28 22:22:13 -04:00
fix_nvt_asphere_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9408 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 17:12:37 +00:00
fix_nvt_omp.cpp
simplify by using utils::strdup() and reorder includes
2021-03-28 22:22:13 -04:00
fix_nvt_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9408 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 17:12:37 +00:00
fix_nvt_sllod_omp.cpp
simplify by using utils::strdup() and reorder includes
2021-03-28 22:22:13 -04:00
fix_nvt_sllod_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9408 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 17:12:37 +00:00
fix_nvt_sphere_omp.cpp
simplify by using utils::strdup() and reorder includes
2021-03-28 22:22:13 -04:00
fix_nvt_sphere_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9408 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-08 17:12:37 +00:00
fix_omp.cpp
correct USER-OMP respa/omp check
2021-03-31 14:55:07 -04:00
fix_omp.h
fix bug in USER-OMP with "pair_modify compute no" and "kspace_modify compute no"
2020-05-15 08:06:23 -04:00
fix_peri_neigh_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
fix_peri_neigh_omp.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
fix_qeq_comb_omp.cpp
use strmatch() consistently to detect respa and verlet runstyles with optional suffix
2021-03-30 18:30:22 -04:00
fix_qeq_comb_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
fix_qeq_reax_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
fix_qeq_reax_omp.h
updated the credits and citations for pair style reaxc/omp and qeq/reax/omp
2017-07-11 08:05:36 -07:00
fix_rigid_nh_omp.cpp
vtally changes to USER packages
2021-01-21 16:06:54 -07:00
fix_rigid_nh_omp.h
update rigid fix styles in USER-OMP for changes in RIGID package
2017-09-08 14:09:44 -04:00
fix_rigid_nph_omp.cpp
simplify by using utils::strdup() and reorder includes
2021-03-28 22:22:13 -04:00
fix_rigid_nph_omp.h
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
fix_rigid_npt_omp.cpp
simplify by using utils::strdup() and reorder includes
2021-03-28 22:22:13 -04:00
fix_rigid_npt_omp.h
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
fix_rigid_nve_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
fix_rigid_nve_omp.h
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
fix_rigid_nvt_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
fix_rigid_nvt_omp.h
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
fix_rigid_omp.cpp
vtally changes to USER packages
2021-01-21 16:06:54 -07:00
fix_rigid_omp.h
2nd set of updates
2018-05-03 17:00:08 -06:00
fix_rigid_small_omp.cpp
vtally changes to USER packages
2021-01-21 16:06:54 -07:00
fix_rigid_small_omp.h
update rigid fix styles in USER-OMP for changes in RIGID package
2017-09-08 14:09:44 -04:00
improper_class2_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
improper_class2_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
improper_cossq_omp.cpp
fix a few more issues in USER-OMP and update indentation
2021-02-24 20:45:07 -05:00
improper_cossq_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
improper_cvff_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
improper_cvff_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
improper_fourier_omp.cpp
more code formatting consistency changes for loops and conditionals
2020-12-30 09:47:45 -05:00
improper_fourier_omp.h
replace leading tabs
2018-03-16 12:34:33 -04:00
improper_harmonic_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
improper_harmonic_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
improper_ring_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
improper_ring_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
improper_umbrella_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
improper_umbrella_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
Install.sh
update dependencies for USER-CGSDK package. make script permissions consistent
2018-05-09 16:13:54 -04:00
msm_cg_omp.cpp
add typecast to avoid (unlikely but possible) integer overflows.
2021-02-02 17:27:04 -05:00
msm_cg_omp.h
kspace refactor compiles for KSPACE and USER-OMP
2018-10-19 15:11:37 -04:00
msm_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
msm_omp.h
kspace refactor compiles for KSPACE and USER-OMP
2018-10-19 15:11:37 -04:00
npair_full_bin_atomonly_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_full_bin_atomonly_omp.h
add "atomonly" optimized neighbor list build styles to USER-OMP
2017-05-30 16:50:38 -04:00
npair_full_bin_ghost_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_full_bin_ghost_omp.h
remove trailing whitespace
2017-05-24 16:29:56 -04:00
npair_full_bin_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_full_bin_omp.h
remove trailing whitespace
2017-05-24 16:29:56 -04:00
npair_full_multi_old_omp.cpp
Renaming multi2->multi npair classes, renaming npair multi variables
2020-12-19 17:09:11 -07:00
npair_full_multi_old_omp.h
Renaming multi->multi/old, updating lmpcite
2020-12-19 16:06:47 -07:00
npair_full_multi_omp.cpp
Adding collection array, new user arguments, and multi communication
2021-02-02 09:39:13 -07:00
npair_full_multi_omp.h
Renaming multi2->multi npair classes, renaming npair multi variables
2020-12-19 17:09:11 -07:00
npair_full_nsq_ghost_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_full_nsq_ghost_omp.h
remove trailing whitespace
2017-05-24 16:29:56 -04:00
npair_full_nsq_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_full_nsq_omp.h
remove trailing whitespace
2017-05-24 16:29:56 -04:00
npair_half_bin_atomonly_newton_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_bin_atomonly_newton_omp.h
add "atomonly" optimized neighbor list build styles to USER-OMP
2017-05-30 16:50:38 -04:00
npair_half_bin_newtoff_ghost_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_bin_newtoff_ghost_omp.h
remove trailing whitespace
2017-05-24 16:29:56 -04:00
npair_half_bin_newtoff_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_bin_newtoff_omp.h
new neighbor list changes
2016-09-07 13:42:58 -06:00
npair_half_bin_newton_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_bin_newton_omp.h
new neighbor list changes
2016-09-07 13:42:58 -06:00
npair_half_bin_newton_tri_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_bin_newton_tri_omp.h
new neighbor list changes
2016-09-07 13:42:58 -06:00
npair_half_multi_newtoff_omp.cpp
Adding collection array, new user arguments, and multi communication
2021-02-02 09:39:13 -07:00
npair_half_multi_newtoff_omp.h
Renaming multi2->multi npair classes, renaming npair multi variables
2020-12-19 17:09:11 -07:00
npair_half_multi_newton_omp.cpp
Adding collection array, new user arguments, and multi communication
2021-02-02 09:39:13 -07:00
npair_half_multi_newton_omp.h
Renaming multi2->multi npair classes, renaming npair multi variables
2020-12-19 17:09:11 -07:00
npair_half_multi_newton_tri_omp.cpp
Adding collection array, new user arguments, and multi communication
2021-02-02 09:39:13 -07:00
npair_half_multi_newton_tri_omp.h
Renaming multi2->multi npair classes, renaming npair multi variables
2020-12-19 17:09:11 -07:00
npair_half_multi_old_newtoff_omp.cpp
Renaming multi2->multi npair classes, renaming npair multi variables
2020-12-19 17:09:11 -07:00
npair_half_multi_old_newtoff_omp.h
Renaming multi->multi/old, updating lmpcite
2020-12-19 16:06:47 -07:00
npair_half_multi_old_newton_omp.cpp
Renaming multi2->multi npair classes, renaming npair multi variables
2020-12-19 17:09:11 -07:00
npair_half_multi_old_newton_omp.h
Renaming multi->multi/old, updating lmpcite
2020-12-19 16:06:47 -07:00
npair_half_multi_old_newton_tri_omp.cpp
Renaming multi2->multi npair classes, renaming npair multi variables
2020-12-19 17:09:11 -07:00
npair_half_multi_old_newton_tri_omp.h
Renaming multi->multi/old, updating lmpcite
2020-12-19 16:06:47 -07:00
npair_half_nsq_newtoff_ghost_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_nsq_newtoff_ghost_omp.h
remove trailing whitespace
2017-05-24 16:29:56 -04:00
npair_half_nsq_newtoff_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_nsq_newtoff_omp.h
new neighbor list changes
2016-09-07 13:42:58 -06:00
npair_half_nsq_newton_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_nsq_newton_omp.h
new neighbor list changes
2016-09-07 13:42:58 -06:00
npair_half_respa_bin_newtoff_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_respa_bin_newtoff_omp.h
remove trailing whitespace
2017-05-24 16:29:56 -04:00
npair_half_respa_bin_newton_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_respa_bin_newton_omp.h
new neighbor list changes
2016-09-07 13:42:58 -06:00
npair_half_respa_bin_newton_tri_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_respa_bin_newton_tri_omp.h
new neighbor list changes
2016-09-07 13:42:58 -06:00
npair_half_respa_nsq_newtoff_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_respa_nsq_newtoff_omp.h
remove trailing whitespace
2017-05-24 16:29:56 -04:00
npair_half_respa_nsq_newton_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_respa_nsq_newton_omp.h
remove trailing whitespace
2017-05-24 16:29:56 -04:00
npair_half_size_bin_newtoff_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_size_bin_newtoff_omp.h
remove trailing whitespace
2017-05-24 16:29:56 -04:00
npair_half_size_bin_newton_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_size_bin_newton_omp.h
new neighbor list changes
2016-09-07 13:42:58 -06:00
npair_half_size_bin_newton_tri_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_size_bin_newton_tri_omp.h
new neighbor list changes
2016-09-07 13:42:58 -06:00
npair_half_size_multi_newtoff_omp.cpp
Adding collection array, new user arguments, and multi communication
2021-02-02 09:39:13 -07:00
npair_half_size_multi_newtoff_omp.h
Renaming multi2->multi npair classes, renaming npair multi variables
2020-12-19 17:09:11 -07:00
npair_half_size_multi_newton_omp.cpp
Adding collection array, new user arguments, and multi communication
2021-02-02 09:39:13 -07:00
npair_half_size_multi_newton_omp.h
Renaming multi2->multi npair classes, renaming npair multi variables
2020-12-19 17:09:11 -07:00
npair_half_size_multi_newton_tri_omp.cpp
Adding collection array, new user arguments, and multi communication
2021-02-02 09:39:13 -07:00
npair_half_size_multi_newton_tri_omp.h
Renaming multi2->multi npair classes, renaming npair multi variables
2020-12-19 17:09:11 -07:00
npair_half_size_multi_old_newtoff_omp.cpp
Fixing typos
2020-12-19 18:07:10 -07:00
npair_half_size_multi_old_newtoff_omp.h
Renaming multi->multi/old, updating lmpcite
2020-12-19 16:06:47 -07:00
npair_half_size_multi_old_newton_omp.cpp
Fixing typos
2020-12-19 18:07:10 -07:00
npair_half_size_multi_old_newton_omp.h
Renaming multi->multi/old, updating lmpcite
2020-12-19 16:06:47 -07:00
npair_half_size_multi_old_newton_tri_omp.cpp
Renaming multi2->multi npair classes, renaming npair multi variables
2020-12-19 17:09:11 -07:00
npair_half_size_multi_old_newton_tri_omp.h
Renaming multi->multi/old, updating lmpcite
2020-12-19 16:06:47 -07:00
npair_half_size_nsq_newtoff_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_size_nsq_newtoff_omp.h
remove trailing whitespace
2017-05-24 16:29:56 -04:00
npair_half_size_nsq_newton_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_half_size_nsq_newton_omp.h
remove trailing whitespace
2017-05-24 16:29:56 -04:00
npair_halffull_newtoff_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_halffull_newtoff_omp.h
Renaming multi->multi/old, updating lmpcite
2020-12-19 16:06:47 -07:00
npair_halffull_newton_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
npair_halffull_newton_omp.h
Renaming multi->multi/old, updating lmpcite
2020-12-19 16:06:47 -07:00
npair_omp.h
new neighbor list changes
2016-09-07 13:42:58 -06:00
npair_skip_omp.h
Renaming multi->multi/old, updating lmpcite
2020-12-19 16:06:47 -07:00
pair_adp_omp.cpp
add typecast to avoid (unlikely but possible) integer overflows.
2021-02-02 17:27:04 -05:00
pair_adp_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_agni_omp.cpp
avoid replicated code, consolidate variables and element mapping
2021-03-27 12:09:36 -04:00
pair_agni_omp.h
port AGNI pair style changes to USER-OMP version
2021-01-19 22:45:31 -05:00
pair_airebo_morse_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_airebo_morse_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14772 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-03-22 13:28:10 +00:00
pair_airebo_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_airebo_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15083 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-05-31 16:33:07 +00:00
pair_beck_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_beck_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_born_coul_long_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_born_coul_long_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_born_coul_msm_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_born_coul_msm_omp.h
whitespace fixes
2020-06-13 01:40:34 -04:00
pair_born_coul_wolf_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_born_coul_wolf_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_born_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_born_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_brownian_omp.cpp
add typecast to avoid (unlikely but possible) integer overflows.
2021-02-02 17:27:04 -05:00
pair_brownian_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14128 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-10-21 18:29:37 +00:00
pair_brownian_poly_omp.cpp
add typecast to avoid (unlikely but possible) integer overflows.
2021-02-02 17:27:04 -05:00
pair_brownian_poly_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14128 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-10-21 18:29:37 +00:00
pair_buck_coul_cut_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_buck_coul_cut_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_buck_coul_long_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_buck_coul_long_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_buck_coul_msm_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_buck_coul_msm_omp.h
whitespace fixes
2020-06-13 01:40:34 -04:00
pair_buck_long_coul_long_omp.cpp
should use ev_init() not ev_setup()
2021-02-09 09:17:08 -05:00
pair_buck_long_coul_long_omp.h
Fix typos in src files
2017-03-05 21:03:40 -05:00
pair_buck_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_buck_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_colloid_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_colloid_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_comb_omp.cpp
avoid replicated code, consolidate variables and element mapping
2021-03-27 12:09:36 -04:00
pair_comb_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_coul_cut_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_coul_cut_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_coul_cut_soft_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_coul_cut_soft_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11953 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-05-09 15:33:03 +00:00
pair_coul_debye_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_coul_debye_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_coul_diel_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_coul_diel_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_coul_dsf_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_coul_dsf_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10907 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-10-30 15:42:14 +00:00
pair_coul_long_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_coul_long_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_coul_long_soft_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_coul_long_soft_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11953 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-05-09 15:33:03 +00:00
pair_coul_msm_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_coul_msm_omp.h
whitespace fixes
2020-06-13 01:40:34 -04:00
pair_coul_wolf_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_coul_wolf_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_dpd_omp.cpp
add typecast to avoid (unlikely but possible) integer overflows.
2021-02-02 17:27:04 -05:00
pair_dpd_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14025 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-09-11 14:49:37 +00:00
pair_dpd_tstat_omp.cpp
add typecast to avoid (unlikely but possible) integer overflows.
2021-02-02 17:27:04 -05:00
pair_dpd_tstat_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14025 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-09-11 14:49:37 +00:00
pair_eam_alloy_omp.cpp
more consistent formatting of for/while loops and if statements
2020-12-30 09:09:08 -05:00
pair_eam_alloy_omp.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_eam_fs_omp.cpp
more consistent formatting of for/while loops and if statements
2020-12-30 09:09:08 -05:00
pair_eam_fs_omp.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_eam_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_eam_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_edip_omp.cpp
avoid replicated code, consolidate variables and element mapping
2021-03-27 12:09:36 -04:00
pair_edip_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_eim_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_eim_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_gauss_cut_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_gauss_cut_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_gauss_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_gauss_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_gayberne_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_gayberne_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_gran_hertz_history_omp.cpp
Adding user-omp support
2021-04-07 07:48:43 -06:00
pair_gran_hertz_history_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15278 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-07-09 20:57:00 +00:00
pair_gran_hooke_history_omp.cpp
Adding user-omp support
2021-04-07 07:48:43 -06:00
pair_gran_hooke_history_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15278 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-07-09 20:57:00 +00:00
pair_gran_hooke_omp.cpp
Adding user-omp support
2021-04-07 07:48:43 -06:00
pair_gran_hooke_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_hbond_dreiding_lj_omp.cpp
add typecast to avoid (unlikely but possible) integer overflows.
2021-02-02 17:27:04 -05:00
pair_hbond_dreiding_lj_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_hbond_dreiding_morse_omp.cpp
add typecast to avoid (unlikely but possible) integer overflows.
2021-02-02 17:27:04 -05:00
pair_hbond_dreiding_morse_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lj96_cut_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj96_cut_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lj_charmm_coul_charmm_implicit_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_charmm_coul_charmm_implicit_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lj_charmm_coul_charmm_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_charmm_coul_charmm_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lj_charmm_coul_long_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_charmm_coul_long_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lj_charmm_coul_long_soft_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_charmm_coul_long_soft_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12010 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-05-22 13:59:00 +00:00
pair_lj_charmm_coul_msm_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_charmm_coul_msm_omp.h
whitespace fixes
2020-06-13 01:40:34 -04:00
pair_lj_class2_coul_cut_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_class2_coul_cut_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lj_class2_coul_long_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_class2_coul_long_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lj_class2_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_class2_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lj_cubic_omp.cpp
increase precision of lj/cubic constants and document how to compute them
2020-12-18 22:33:56 -05:00
pair_lj_cubic_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lj_cut_coul_cut_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_cut_coul_cut_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lj_cut_coul_cut_soft_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_cut_coul_cut_soft_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11953 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-05-09 15:33:03 +00:00
pair_lj_cut_coul_debye_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_cut_coul_debye_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lj_cut_coul_dsf_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_cut_coul_dsf_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10907 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-10-30 15:42:14 +00:00
pair_lj_cut_coul_long_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_cut_coul_long_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lj_cut_coul_long_soft_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_cut_coul_long_soft_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11953 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-05-09 15:33:03 +00:00
pair_lj_cut_coul_msm_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_cut_coul_msm_omp.h
whitespace fixes
2020-06-13 01:40:34 -04:00
pair_lj_cut_coul_wolf_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_cut_coul_wolf_omp.h
add USER-OMP versions of lj/cut/coul/wolf
2018-02-18 16:38:50 +01:00
pair_lj_cut_dipole_cut_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_cut_dipole_cut_omp.h
remove executable permissions on non-executables and non-scripts
2016-09-08 14:45:07 -04:00
pair_lj_cut_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_cut_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lj_cut_soft_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_cut_soft_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11953 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-05-09 15:33:03 +00:00
pair_lj_cut_thole_long_omp.cpp
more consistent formatting of for/while loops and if statements
2020-12-30 09:09:08 -05:00
pair_lj_cut_thole_long_omp.h
final second round IWYU cleanup
2020-09-04 08:01:11 -04:00
pair_lj_cut_tip4p_cut_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_cut_tip4p_cut_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9613 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-03-07 20:47:54 +00:00
pair_lj_cut_tip4p_long_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_cut_tip4p_long_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9542 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-20 15:21:22 +00:00
pair_lj_cut_tip4p_long_soft_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_cut_tip4p_long_soft_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11953 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-05-09 15:33:03 +00:00
pair_lj_expand_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_expand_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lj_gromacs_coul_gromacs_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_gromacs_coul_gromacs_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lj_gromacs_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_gromacs_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lj_long_coul_long_omp.cpp
should use ev_init() not ev_setup()
2021-02-09 09:17:08 -05:00
pair_lj_long_coul_long_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13937 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-08-28 20:00:56 +00:00
pair_lj_long_tip4p_long_omp.cpp
should use ev_init() not ev_setup()
2021-02-09 09:17:08 -05:00
pair_lj_long_tip4p_long_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13937 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-08-28 20:00:56 +00:00
pair_lj_relres_omp.cpp
add multi-thread version of lj/relres
2021-02-09 09:24:19 -05:00
pair_lj_relres_omp.h
add multi-thread version of lj/relres
2021-02-09 09:24:19 -05:00
pair_lj_sdk_coul_long_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_sdk_coul_long_omp.h
remove cg/cmm style name aliases
2017-04-26 17:24:25 -04:00
pair_lj_sdk_coul_msm_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_sdk_coul_msm_omp.h
remove cg/cmm style name aliases
2017-04-26 17:24:25 -04:00
pair_lj_sdk_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_sdk_omp.h
remove cg/cmm style name aliases
2017-04-26 17:24:25 -04:00
pair_lj_sf_dipole_sf_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_sf_dipole_sf_omp.h
remove executable permissions on non-executables and non-scripts
2016-09-08 14:45:07 -04:00
pair_lj_smooth_linear_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_smooth_linear_omp.h
alias pair style lj/sf to lj/smooth/linear and remove/update related files
2017-06-06 17:26:06 -04:00
pair_lj_smooth_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_lj_smooth_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lubricate_omp.cpp
more consistent formatting of for/while loops and if statements
2020-12-30 09:09:08 -05:00
pair_lubricate_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_lubricate_poly_omp.cpp
more consistent formatting of for/while loops and if statements
2020-12-30 09:09:08 -05:00
pair_lubricate_poly_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_meam_spline_omp.cpp
more consistent formatting of for/while loops and if statements
2020-12-30 09:09:08 -05:00
pair_meam_spline_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_morse_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_morse_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_morse_smooth_linear_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_morse_smooth_linear_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14776 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-03-22 13:44:25 +00:00
pair_nm_cut_coul_cut_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_nm_cut_coul_cut_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10907 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-10-30 15:42:14 +00:00
pair_nm_cut_coul_long_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_nm_cut_coul_long_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10907 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-10-30 15:42:14 +00:00
pair_nm_cut_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_nm_cut_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10907 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-10-30 15:42:14 +00:00
pair_peri_lps_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_peri_lps_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_peri_pmb_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_peri_pmb_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_reaxc_omp.cpp
more code formatting consistency changes for loops and conditionals
2020-12-30 09:47:45 -05:00
pair_reaxc_omp.h
add centroid virial argument (cvatom) to ThrOMP::ev_setup_thr, and modify all related styles to pass a NULL pointer to pass compilation
2019-10-04 19:14:05 +09:00
pair_rebo_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_rebo_omp.h
Merge branch 'github-rebo-bugfix' of https://github.com/CF17/lammps into test-rebo
2018-12-30 03:44:38 -05:00
pair_resquared_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_resquared_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_soft_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_soft_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_sw_omp.cpp
avoid replicated code, consolidate variables and element mapping
2021-03-27 12:09:36 -04:00
pair_sw_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_table_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_table_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_tersoff_mod_c_omp.cpp
avoid replicated code, consolidate variables and element mapping
2021-03-27 12:09:36 -04:00
pair_tersoff_mod_c_omp.h
hoist "shift_flag" outside of inner loops.
2021-01-22 12:27:22 -05:00
pair_tersoff_mod_omp.cpp
avoid replicated code, consolidate variables and element mapping
2021-03-27 12:09:36 -04:00
pair_tersoff_mod_omp.h
hoist "shift_flag" outside of inner loops.
2021-01-22 12:27:22 -05:00
pair_tersoff_omp.cpp
avoid replicated code, consolidate variables and element mapping
2021-03-27 12:09:36 -04:00
pair_tersoff_omp.h
attempt to reduce the negative performance impact of adding the shift option
2021-01-11 04:20:43 -05:00
pair_tersoff_table_omp.cpp
avoid replicated code, consolidate variables and element mapping
2021-03-27 12:09:36 -04:00
pair_tersoff_table_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11725 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-04-07 19:45:15 +00:00
pair_tersoff_zbl_omp.cpp
Merge branch 'master' into tersoff-shift
2021-01-11 04:30:11 -05:00
pair_tersoff_zbl_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_tip4p_cut_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_tip4p_cut_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10292 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-07-23 15:21:27 +00:00
pair_tip4p_long_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_tip4p_long_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10292 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-07-23 15:21:27 +00:00
pair_tip4p_long_soft_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_tip4p_long_soft_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11953 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-05-09 15:33:03 +00:00
pair_ufm_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_ufm_omp.h
Added the UFM files (doc/src - lib/gpu - src)
2017-10-24 11:11:10 -02:00
pair_vashishta_omp.cpp
avoid replicated code, consolidate variables and element mapping
2021-03-27 12:09:36 -04:00
pair_vashishta_omp.h
Added vashishta to USER-OMP from Axel
2015-10-21 03:57:35 +00:00
pair_vashishta_table_omp.cpp
avoid replicated code, consolidate variables and element mapping
2021-03-27 12:09:36 -04:00
pair_vashishta_table_omp.h
implement vashishta/table/omp in USER-OMP
2016-09-08 17:22:03 -04:00
pair_yukawa_colloid_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_yukawa_colloid_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_yukawa_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pair_yukawa_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8864 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-10-02 20:00:06 +00:00
pair_zbl_omp.cpp
move static constants in pair style out of the globally included header
2020-12-17 14:03:15 -05:00
pair_zbl_omp.h
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10907 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-10-30 15:42:14 +00:00
pppm_cg_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pppm_cg_omp.h
kspace refactor compiles for KSPACE and USER-OMP
2018-10-19 15:11:37 -04:00
pppm_disp_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pppm_disp_omp.h
kspace refactor compiles for KSPACE and USER-OMP
2018-10-19 15:11:37 -04:00
pppm_disp_tip4p_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pppm_disp_tip4p_omp.h
kspace refactor compiles for KSPACE and USER-OMP
2018-10-19 15:11:37 -04:00
pppm_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pppm_omp.h
kspace refactor compiles for KSPACE and USER-OMP
2018-10-19 15:11:37 -04:00
pppm_tip4p_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
pppm_tip4p_omp.h
kspace refactor compiles for KSPACE and USER-OMP
2018-10-19 15:11:37 -04:00
README
get rid of tabs and trailing whitespace
2020-06-15 17:37:45 -04:00
reaxc_bond_orders_omp.cpp
more code formatting consistency changes for loops and conditionals
2020-12-30 09:47:45 -05:00
reaxc_bond_orders_omp.h
final second round IWYU cleanup
2020-09-04 08:01:11 -04:00
reaxc_bonds_omp.cpp
more consistent formatting of for/while loops and if statements
2020-12-30 09:09:08 -05:00
reaxc_bonds_omp.h
more whitespace cleanup
2018-03-15 22:02:02 -04:00
reaxc_forces_omp.cpp
avoid overflows when computing time or timestep related values
2021-02-06 18:15:24 -05:00
reaxc_forces_omp.h
more include handling cleanup in USER packages
2019-07-12 18:00:59 -04:00
reaxc_hydrogen_bonds_omp.cpp
more code formatting consistency changes for loops and conditionals
2020-12-30 09:47:45 -05:00
reaxc_hydrogen_bonds_omp.h
more whitespace cleanup
2018-03-15 22:02:02 -04:00
reaxc_init_md_omp.cpp
more consistent formatting of for/while loops and if statements
2020-12-30 09:09:08 -05:00
reaxc_init_md_omp.h
final second round IWYU cleanup
2020-09-04 08:01:11 -04:00
reaxc_multi_body_omp.cpp
more code formatting consistency changes for loops and conditionals
2020-12-30 09:47:45 -05:00
reaxc_multi_body_omp.h
more whitespace cleanup
2018-03-15 22:02:02 -04:00
reaxc_nonbonded_omp.cpp
more code formatting consistency changes for loops and conditionals
2020-12-30 09:47:45 -05:00
reaxc_nonbonded_omp.h
replace leading tabs
2018-03-16 12:34:33 -04:00
reaxc_torsion_angles_omp.cpp
more code formatting consistency changes for loops and conditionals
2020-12-30 09:47:45 -05:00
reaxc_torsion_angles_omp.h
replace leading tabs
2018-03-16 12:34:33 -04:00
reaxc_valence_angles_omp.cpp
more consistent formatting of for/while loops and if statements
2020-12-30 09:09:08 -05:00
reaxc_valence_angles_omp.h
more whitespace cleanup
2018-03-15 22:02:02 -04:00
respa_omp.cpp
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
respa_omp.h
default arguments on polymorph/pure methods can lead to unexpected overloading in derived classes
2018-02-22 07:53:58 -05:00
thr_data.cpp
remove dead code
2021-03-15 17:00:27 -04:00
thr_data.h
remove dead code
2021-03-15 17:00:27 -04:00
thr_omp.cpp
Make use of ENERGY_ and VIRIAL_ constants
2020-11-16 15:33:15 -05:00
thr_omp.h
add centroid virial argument (cvatom) to ThrOMP::ev_setup_thr, and modify all related styles to pass a NULL pointer to pass compilation
2019-10-04 19:14:05 +09:00

README 

This package provides OpenMP multi-threading support and other
optimizations of various LAMMPS pair styles, dihedral styles, and fix
styles.

See this section of the manual to get started:

doc/Section_accelerate.html, sub-section 5.2

The person who created this package is Axel Kohlmeyer at Temple U
(akohlmey at gmail.com).  Contact him directly if you have questions.