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767a0d4f60c273cb65f6f269c072c3f2bb846c68
lammps/examples/USER/openmp
History
Axel Kohlmeyer a5e119a167 fix final glitch in tip4p specific ev_tally call
2010-07-22 10:28:05 -04:00
..
.gitignore
added log file from successful runs on regular and
2010-04-28 19:35:24 -04:00
CH.airebo
added test example input for AIREBO.
2010-05-28 13:43:44 -04:00
Cu_u3.eam
add a bunch more examples for tests and benchmarks.
2010-06-05 18:48:21 -04:00
data.bucky-swcnt
added test example input for AIREBO.
2010-05-28 13:43:44 -04:00
data.dpd
new and much smaller tests for dpd and soft.
2010-06-02 18:14:36 -04:00
data.gauss-diel
added OpenMP version of the gauss potential.
2010-05-25 14:14:57 -04:00
data.pegc12e8
add a bunch more examples for tests and benchmarks.
2010-06-05 18:48:21 -04:00
data.rhodo
add example input for OpenMP enable CHARMM pair style.
2010-05-05 23:14:48 -04:00
data.tip4p
add test input for tip4p water.
2010-07-22 10:12:38 -04:00
in.bucky-swcnt-airebo
adjust inputs for new fix wall/reflect syntax
2010-06-04 10:52:16 -04:00
in.bucky-swcnt-airebo-omp
adjust inputs for new fix wall/reflect syntax
2010-06-04 10:52:16 -04:00
in.colloid
added example input for colloid pair style.
2010-06-05 21:53:57 -04:00
in.colloid-omp
added example input for colloid pair style.
2010-06-05 21:53:57 -04:00
in.dipole
add a bunch more examples for tests and benchmarks.
2010-06-05 18:48:21 -04:00
in.dipole-omp
add a bunch more examples for tests and benchmarks.
2010-06-05 18:48:21 -04:00
in.dpd
adapt pair style soft/omp to mainline changes.
2010-06-20 17:52:37 -04:00
in.dpd-omp
adapt pair style soft/omp to mainline changes.
2010-06-20 17:52:37 -04:00
in.dpd-tstat
adapt pair style soft/omp to mainline changes.
2010-06-20 17:52:37 -04:00
in.dpd-tstat-omp
adapt pair style soft/omp to mainline changes.
2010-06-20 17:52:37 -04:00
in.eam
add a bunch more examples for tests and benchmarks.
2010-06-05 18:48:21 -04:00
in.eam-omp
add a bunch more examples for tests and benchmarks.
2010-06-05 18:48:21 -04:00
in.ellipse.gayberne
demo/test examples for OpenMP variants of asphere
2010-06-05 19:32:29 -04:00
in.ellipse.gayberne-omp
demo/test examples for OpenMP variants of asphere
2010-06-05 19:32:29 -04:00
in.ellipse.resquared
demo/test examples for OpenMP variants of asphere
2010-06-05 19:32:29 -04:00
in.ellipse.resquared-omp
demo/test examples for OpenMP variants of asphere
2010-06-05 19:32:29 -04:00
in.ewald-omp
input example for OpenMP ewald.
2010-06-02 14:54:36 -04:00
in.gauss-diel-dihedral-omp
add test and benchmark input for opls/omp
2010-06-03 19:10:06 -04:00
in.gauss-diel-omp
add omp version for ewald (not yet threaded).
2010-06-02 14:22:19 -04:00
in.melt
increased problem set size in melt demo.
2010-04-28 21:36:23 -04:00
in.melt-newton
a few more input variants to test.
2010-04-29 09:46:41 -04:00
in.melt-omp
increased problem set size in melt demo.
2010-04-28 21:36:23 -04:00
in.melt-omp+newton
a few more input variants to test.
2010-04-29 09:46:41 -04:00
in.melt-opt
a few more input variants to test.
2010-04-29 09:46:41 -04:00
in.melt-table
improved & expanded test for tabulated potentials
2010-05-27 14:48:21 -04:00
in.melt-write
add test input for tabulated potentials.
2010-05-26 17:11:35 -04:00
in.pegc12e8
add a bunch more examples for tests and benchmarks.
2010-06-05 18:48:21 -04:00
in.pegc12e8-omp
add a bunch more examples for tests and benchmarks.
2010-06-05 18:48:21 -04:00
in.pour
add example/test input for granular pair styles.
2010-06-06 16:45:10 -04:00
in.pour-omp
add example/test input for granular pair styles.
2010-06-06 16:45:10 -04:00
in.rhodo-omp
add example input for OpenMP enable CHARMM pair style.
2010-05-05 23:14:48 -04:00
in.si-vacancy
added test example for stillinger-weber potential.
2010-05-28 11:17:58 -04:00
in.si-vacancy-omp
added test example for stillinger-weber potential.
2010-05-28 11:17:58 -04:00
in.tersoff
added OpenMP versions of tersoff and tersoff/zbl
2010-05-31 17:40:54 -04:00
in.tersoff_zbl
add test for tersoff/zbl
2010-05-31 18:50:25 -04:00
in.tersoff_zbl-omp
add test for tersoff/zbl
2010-05-31 18:50:25 -04:00
in.tersoff-omp
add test for tersoff/zbl
2010-05-31 18:50:25 -04:00
in.tip4p-long
add test input for tip4p water.
2010-07-22 10:12:38 -04:00
in.tip4p-long-omp
add test input for tip4p water.
2010-07-22 10:12:38 -04:00
lj_table.txt
potential table file for tabulated potential test.
2010-05-27 14:50:23 -04:00
log.buck-swcnt-airebo
added test example input for AIREBO.
2010-05-28 13:43:44 -04:00
log.buck-swcnt-airebo-omp
added test example input for AIREBO.
2010-05-28 13:43:44 -04:00
log.colloid
added example input for colloid pair style.
2010-06-05 21:53:57 -04:00
log.colloid-omp
added example input for colloid pair style.
2010-06-05 21:53:57 -04:00
log.dipole
add a bunch more examples for tests and benchmarks.
2010-06-05 18:48:21 -04:00
log.dipole-omp
add a bunch more examples for tests and benchmarks.
2010-06-05 18:48:21 -04:00
log.dpd
adapt pair style soft/omp to mainline changes.
2010-06-20 17:52:37 -04:00
log.dpd-omp
adapt pair style soft/omp to mainline changes.
2010-06-20 17:52:37 -04:00
log.dpd-omp2
adapt pair style soft/omp to mainline changes.
2010-06-20 17:52:37 -04:00
log.dpd-tstat
adapt pair style soft/omp to mainline changes.
2010-06-20 17:52:37 -04:00
log.dpd-tstat-omp
adapt pair style soft/omp to mainline changes.
2010-06-20 17:52:37 -04:00
log.dpd-tstat-omp2
adapt pair style soft/omp to mainline changes.
2010-06-20 17:52:37 -04:00
log.eam
add a bunch more examples for tests and benchmarks.
2010-06-05 18:48:21 -04:00
log.eam-omp
add a bunch more examples for tests and benchmarks.
2010-06-05 18:48:21 -04:00
log.ewald-omp
input example for OpenMP ewald.
2010-06-02 14:54:36 -04:00
log.gauss-diel-dihedral-omp
add test and benchmark input for opls/omp
2010-06-03 19:10:06 -04:00
log.gayberne
demo/test examples for OpenMP variants of asphere
2010-06-05 19:32:29 -04:00
log.gayberne-omp
demo/test examples for OpenMP variants of asphere
2010-06-05 19:32:29 -04:00
log.melt
increased problem set size in melt demo.
2010-04-28 21:36:23 -04:00
log.melt-omp
increased problem set size in melt demo.
2010-04-28 21:36:23 -04:00
log.melt-omp-omp
increased problem set size in melt demo.
2010-04-28 21:36:23 -04:00
log.melt-table
improved & expanded test for tabulated potentials
2010-05-27 14:48:21 -04:00
log.pour
add example/test input for granular pair styles.
2010-06-06 16:45:10 -04:00
log.pour-omp
add example/test input for granular pair styles.
2010-06-06 16:45:10 -04:00
log.resquared
demo/test examples for OpenMP variants of asphere
2010-06-05 19:32:29 -04:00
log.resquared-omp
demo/test examples for OpenMP variants of asphere
2010-06-05 19:32:29 -04:00
log.si-vacancy
added test example for stillinger-weber potential.
2010-05-28 11:17:58 -04:00
log.si-vacancy-omp
added test example for stillinger-weber potential.
2010-05-28 11:17:58 -04:00
log.si-vacancy-omp-2t
added test example for stillinger-weber potential.
2010-05-28 11:17:58 -04:00
log.tip4p-long
fix final glitch in tip4p specific ev_tally call
2010-07-22 10:28:05 -04:00
log.tip4p-long-omp
fix final glitch in tip4p specific ev_tally call
2010-07-22 10:28:05 -04:00
parm.pegc12e8
add a bunch more examples for tests and benchmarks.
2010-06-05 18:48:21 -04:00
parm.pegc12e8-omp
add a bunch more examples for tests and benchmarks.
2010-06-05 18:48:21 -04:00
Si.sw
added test example for stillinger-weber potential.
2010-05-28 11:17:58 -04:00
Si.tersoff
added OpenMP versions of tersoff and tersoff/zbl
2010-05-31 17:40:54 -04:00
SiC.tersoff.zbl
add test for tersoff/zbl
2010-05-31 18:50:25 -04:00