lammps/examples/USER/quip
Axel Kohlmeyer 7d0d701eaf add reference outputs for QUIP/GAP example 2017-07-28 16:05:16 -04:00
..
data_gap git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13150 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-02-24 16:28:56 +00:00
data_sw git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13150 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-02-24 16:28:56 +00:00
gap_example.xml git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13150 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-02-24 16:28:56 +00:00
gap_example_sparse.dat git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13150 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-02-24 16:28:56 +00:00
in.gap update QUIP examples to closer match typical LAMMPS examples 2017-07-28 15:20:33 -04:00
in.molecular update QUIP examples to closer match typical LAMMPS examples 2017-07-28 15:20:33 -04:00
in.sw update QUIP examples to closer match typical LAMMPS examples 2017-07-28 15:20:33 -04:00
log.24Jul17.gap.g++.1 add reference outputs for QUIP/GAP example 2017-07-28 16:05:16 -04:00
log.24Jul17.gap.g++.4 add reference outputs for QUIP/GAP example 2017-07-28 16:05:16 -04:00
log.24Jul17.molecular.g++.1 update QUIP examples to closer match typical LAMMPS examples 2017-07-28 15:20:33 -04:00
log.24Jul17.molecular.g++.4 update QUIP examples to closer match typical LAMMPS examples 2017-07-28 15:20:33 -04:00
log.24Jul17.sw.g++.1 update QUIP examples to closer match typical LAMMPS examples 2017-07-28 15:20:33 -04:00
log.24Jul17.sw.g++.4 update QUIP examples to closer match typical LAMMPS examples 2017-07-28 15:20:33 -04:00
methane-box-8.data Add a (contrived) molecular example for USER-QUIP 2017-07-22 01:33:15 +01:00
out.molecular Add a (contrived) molecular example for USER-QUIP 2017-07-22 01:33:15 +01:00
sw_example.xml git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13150 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-02-24 16:28:56 +00:00