HvD: Updating the baselines to get the molecular orientations right.

2026-07-27 21:55:30 -04:00 · 2013-09-25 05:04:07 +00:00 · 2013-09-25 05:04:07 +00:00 · fc2f622000
commit fc2f622000
parent 1a98bbf12d
8 changed files with 15582 additions and 15009 deletions
--- a/QA/tests/cosmo_h3co/cosmo_h3co.out
+++ b/QA/tests/cosmo_h3co/cosmo_h3co.out
--- a/QA/tests/cosmo_h3co_ecp/cosmo_h3co_ecp.out
+++ b/QA/tests/cosmo_h3co_ecp/cosmo_h3co_ecp.out
--- a/QA/tests/cosmo_h3co_gp/cosmo_h3co_gp.out
+++ b/QA/tests/cosmo_h3co_gp/cosmo_h3co_gp.out
--- a/QA/tests/dft_mpw1k/dft_mpw1k.out
+++ b/QA/tests/dft_mpw1k/dft_mpw1k.out
--- a/QA/tests/dft_s12gh/dft_s12gh.out
+++ b/QA/tests/dft_s12gh/dft_s12gh.out
--- a/QA/tests/dielsalder/dielsalder.out
+++ b/QA/tests/dielsalder/dielsalder.out
--- a/QA/tests/h2o_opt/h2o_opt.out
+++ b/QA/tests/h2o_opt/h2o_opt.out
--- a/QA/tests/sadsmall/sadsmall.out
+++ b/QA/tests/sadsmall/sadsmall.out