Navraj Lalli 96c776c51f Add log files for qtpie/reaxff examples

2024-09-13 18:08:14 +01:00

..

acks2_ff.water

move ACKS2 force field file to potentials folder and add LAMMPS-style metadata

2021-09-21 14:37:37 -04:00

data.water

Tweak example and add reference logs

2021-09-20 13:01:57 -06:00

gauss_exp.txt

Add water examples featuring fix qtpie/reaxff

2024-09-10 16:20:51 +01:00

in.water.acks2

whitespace

2021-10-13 18:25:13 -04:00

in.water.acks2.field

whitespace

2021-10-13 18:25:13 -04:00

in.water.qeq

whitespace

2021-10-13 18:25:13 -04:00

in.water.qeq.field

whitespace

2021-10-13 18:25:13 -04:00

in.water.qtpie

Add water examples featuring fix qtpie/reaxff

2024-09-10 16:20:51 +01:00

in.water.qtpie.field

Add water examples featuring fix qtpie/reaxff

2024-09-10 16:20:51 +01:00

log.13Oct21.reaxff.water-acks2-field.g++.1

Update log files

2021-10-13 14:03:50 -06:00

log.13Oct21.reaxff.water-acks2-field.g++.4

Update log files

2021-10-13 14:03:50 -06:00

log.13Oct21.reaxff.water-acks2.g++.1

Update log files

2021-10-13 14:03:50 -06:00

log.13Oct21.reaxff.water-acks2.g++.4

Update log files

2021-10-13 14:03:50 -06:00

log.13Oct21.reaxff.water-qeq-field.g++.1

Update log files

2021-10-13 14:03:50 -06:00

log.13Oct21.reaxff.water-qeq-field.g++.4

Update log files

2021-10-13 14:03:50 -06:00

log.13Oct21.reaxff.water-qeq.g++.1

Update log files

2021-10-13 14:03:50 -06:00

log.13Oct21.reaxff.water-qeq.g++.4

Update log files

2021-10-13 14:03:50 -06:00

log.29Aug24.reaxff.water-qtpie-field.g++.1

Add log files for qtpie/reaxff examples

2024-09-13 18:08:14 +01:00

log.29Aug24.reaxff.water-qtpie-field.g++.4

Add log files for qtpie/reaxff examples

2024-09-13 18:08:14 +01:00

log.29Aug24.reaxff.water-qtpie.g++.1

Add log files for qtpie/reaxff examples

2024-09-13 18:08:14 +01:00

log.29Aug24.reaxff.water-qtpie.g++.4

Add log files for qtpie/reaxff examples

2024-09-13 18:08:14 +01:00

qeq_ff.water

Add ACKS2 example

2021-09-20 12:23:19 -06:00