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Fixing tests

This commit is contained in:
Anthony Scemama 2019-01-05 03:10:56 +01:00
parent cbf86db3d0
commit b8bd99d449

View File

@ -70,7 +70,7 @@ function run() {
@test "CH4" {
qp_set_mo_class ch4.ezfio -core "[1]" -act "[2-30]" -del "[31-59]"
run ch4.ezfio -40.2403916383084 -39.8433214756675
run ch4.ezfio -40.2403962667047 -39.8433221754964
}
@test "CO2" {