diff --git a/src/fci/40.fci.bats b/src/fci/40.fci.bats index 3c4a93c7..889bf90a 100644 --- a/src/fci/40.fci.bats +++ b/src/fci/40.fci.bats @@ -209,7 +209,7 @@ function run_stoch() { [[ -n $TRAVIS ]] && skip qp set_file cu_nh3_4_2plus.ezfio qp set_mo_class --core="[1-24]" --act="[25-45]" --del="[46-87]" - run -1862.9869374387192 3.e-04 100000 + run -1862.98320066637 3.e-04 100000 } @test "HCN" { # 20.3273s