NWChem/QA/runtest.md
2009-04-08 21:12:22 +00:00

387 B
Executable file

#!/bin/sh

cd /tmp runtest.unix procs 2
$NWCHEM_TEST/na_k/nak
$NWCHEM_TEST/na_k/nak_md
$NWCHEM_TEST/crown/crown_md
$NWCHEM_TEST/ethanol/ethanol_md
$NWCHEM_TEST/ethanol/ethanol_ti
$NWCHEM_TEST/had/had_em
$NWCHEM_TEST/had/had_md
$NWCHEM_TEST/prep/a3n
$NWCHEM_TEST/prep/aal
$NWCHEM_TEST/prep/fsc
$NWCHEM_TEST/water/water_md

$NWCHEM_TEST/h2o_qmd/h2o_scf