diff --git a/src/fci/40.fci.bats b/src/fci/40.fci.bats index d3809ff3..f3b7db2c 100644 --- a/src/fci/40.fci.bats +++ b/src/fci/40.fci.bats @@ -48,12 +48,12 @@ function run_stoch() { @test "DHNO" { # 11.4721s qp set_file dhno.ezfio qp set_mo_class --core="[1-7]" --act="[8-64]" - run -130.458875747063 1.e-5 + run -130.459020029816 1.e-5 } @test "HCO" { # 12.2868s qp set_file hco.ezfio - run -113.296794173622 2.e-05 + run -113.297494345682 2.e-05 } @test "H2O2" { # 12.9214s