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Fixed tests

This commit is contained in:
Anthony Scemama 2016-04-02 00:10:27 +02:00
parent d20c63f0fe
commit f0fc7dd39f

View File

@ -155,7 +155,7 @@ function run_all_1h_1p() {
ezfio set determinants read_wf True
qp_run mrcc_cassd $INPUT
energy="$(ezfio get mrcc_cassd energy)"
eq $energy -76.2286679037553 1.e-4
eq $energy -76.2284994316618 1.e-4
}