lammps/examples/snap
Aidan Thompson 9d0aee7426 Added doc page for compute mliap and updated examples 2020-07-03 13:43:51 -06:00
..
He_He_JW2013.table make He table potentials canonical and add UNITS: tag 2020-06-14 10:46:56 -04:00
InP_JCPA2020.snap Renamed InP potential files and create standard log files 2020-06-13 10:47:29 -06:00
InP_JCPA2020.snapcoeff Renamed InP potential files and create standard log files 2020-06-13 10:47:29 -06:00
InP_JCPA2020.snapparam Renamed InP potential files and create standard log files 2020-06-13 10:47:29 -06:00
Mo_Chen_PRM2017.snap Removed redundant element list from pair_coeff snap syntax 2018-12-03 20:28:01 -07:00
Mo_Chen_PRM2017.snapcoeff Removed redundant element list from pair_coeff snap syntax 2018-12-03 20:28:01 -07:00
Mo_Chen_PRM2017.snapparam Removed redundant element list from pair_coeff snap syntax 2018-12-03 20:28:01 -07:00
Ta06A.snap Removed redundant element list from pair_coeff snap syntax 2018-12-03 20:28:01 -07:00
Ta06A.snapcoeff Removed redundant element list from pair_coeff snap syntax 2018-12-03 20:28:01 -07:00
Ta06A.snapparam Removed redundant element list from pair_coeff snap syntax 2018-12-03 20:28:01 -07:00
WBe_Wood_PRB2019.snap Added W-Be example to example/snap folder 2019-09-18 14:34:20 -06:00
WBe_Wood_PRB2019.snapcoeff Added W-Be example to example/snap folder 2019-09-18 14:34:20 -06:00
WBe_Wood_PRB2019.snapparam Added W-Be example to example/snap folder 2019-09-18 14:34:20 -06:00
W_2940_2017_2.snap Removed redundant element list from pair_coeff snap syntax 2018-12-03 20:28:01 -07:00
W_2940_2017_2.snapcoeff Removed redundant element list from pair_coeff snap syntax 2018-12-03 20:28:01 -07:00
W_2940_2017_2.snapparam Removed redundant element list from pair_coeff snap syntax 2018-12-03 20:28:01 -07:00
W_2940_2017_2_He_JW2013.snap Removed redundant element list from pair_coeff snap syntax 2018-12-03 20:28:01 -07:00
W_He_JW2013.table make He table potentials canonical and add UNITS: tag 2020-06-14 10:46:56 -04:00
in.snap.InP.JCPA2020 change input and log files for new example to give consistent results in serial and parallel. 2020-06-16 21:11:34 -04:00
in.snap.Mo_Chen update SNAP package inputs and reference logs to give consistent results in serial and parallel 2020-06-16 20:59:58 -04:00
in.snap.Ta06A update SNAP package inputs and reference logs to give consistent results in serial and parallel 2020-06-16 20:59:58 -04:00
in.snap.W.2940 update SNAP package inputs and reference logs to give consistent results in serial and parallel 2020-06-16 20:59:58 -04:00
in.snap.WBe.PRB2019 update SNAP package inputs and reference logs to give consistent results in serial and parallel 2020-06-16 20:59:58 -04:00
in.snap.compute Changed the compute examples to expose effect of different list orderings 2020-07-02 14:43:48 -06:00
in.snap.compute.quadratic Added doc page for compute mliap and updated examples 2020-07-03 13:43:51 -06:00
in.snap.hybrid.WSNAP.HePair update SNAP package inputs and reference logs to give consistent results in serial and parallel 2020-06-16 20:59:58 -04:00
log.03Jul20.snap.compute.g++.1 Added doc page for compute mliap and updated examples 2020-07-03 13:43:51 -06:00
log.03Jul20.snap.compute.g++.4 Added doc page for compute mliap and updated examples 2020-07-03 13:43:51 -06:00
log.03Jul20.snap.compute.quadratic.g++.1 Added doc page for compute mliap and updated examples 2020-07-03 13:43:51 -06:00
log.03Jul20.snap.compute.quadratic.g++.4 Added doc page for compute mliap and updated examples 2020-07-03 13:43:51 -06:00
log.15Jun20.snap.InP.JCPA2020.g++.1 change input and log files for new example to give consistent results in serial and parallel. 2020-06-16 21:11:34 -04:00
log.15Jun20.snap.InP.JCPA2020.g++.4 change input and log files for new example to give consistent results in serial and parallel. 2020-06-16 21:11:34 -04:00
log.15Jun20.snap.Mo_Chen.g++.1 update SNAP package inputs and reference logs to give consistent results in serial and parallel 2020-06-16 20:59:58 -04:00
log.15Jun20.snap.Mo_Chen.g++.4 update SNAP package inputs and reference logs to give consistent results in serial and parallel 2020-06-16 20:59:58 -04:00
log.15Jun20.snap.Ta06A.g++.1 update SNAP package inputs and reference logs to give consistent results in serial and parallel 2020-06-16 20:59:58 -04:00
log.15Jun20.snap.Ta06A.g++.4 update SNAP package inputs and reference logs to give consistent results in serial and parallel 2020-06-16 20:59:58 -04:00
log.15Jun20.snap.W.2940.g++.1 update SNAP package inputs and reference logs to give consistent results in serial and parallel 2020-06-16 20:59:58 -04:00
log.15Jun20.snap.W.2940.g++.4 update SNAP package inputs and reference logs to give consistent results in serial and parallel 2020-06-16 20:59:58 -04:00
log.15Jun20.snap.WBe.PRB2019.g++.1 update SNAP package inputs and reference logs to give consistent results in serial and parallel 2020-06-16 20:59:58 -04:00
log.15Jun20.snap.WBe.PRB2019.g++.4 update SNAP package inputs and reference logs to give consistent results in serial and parallel 2020-06-16 20:59:58 -04:00
log.15Jun20.snap.hybrid.WSNAP.HePair.g++.1 update SNAP package inputs and reference logs to give consistent results in serial and parallel 2020-06-16 20:59:58 -04:00
log.15Jun20.snap.hybrid.WSNAP.HePair.g++.4 update SNAP package inputs and reference logs to give consistent results in serial and parallel 2020-06-16 20:59:58 -04:00