Axel Kohlmeyer 169d93ef1f add test for tersoff/zbl

2010-05-31 18:50:25 -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

data.bucky-swcnt

added test example input for AIREBO.

2010-05-28 13:43:44 -04:00

data.gauss-diel

added OpenMP version of the gauss potential.

2010-05-25 14:14:57 -04:00

data.rhodo

add example input for OpenMP enable CHARMM pair style.

2010-05-05 23:14:48 -04:00

in.bucky-swcnt-airebo

added test example input for AIREBO.

2010-05-28 13:43:44 -04:00

in.bucky-swcnt-airebo-omp

added test example input for AIREBO.

2010-05-28 13:43:44 -04:00

in.gauss-diel-omp

use more /omp styles in test examples.

2010-05-25 19:35:55 -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.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

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.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.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

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