From 7db4bf509b9f673c6dd933e33752ef69dfe38a03 Mon Sep 17 00:00:00 2001 From: Anthony Scemama Date: Mon, 16 Oct 2017 18:28:54 +0200 Subject: [PATCH] Fixed tests --- tests/bats/fci.bats | 3 ++- 1 file changed, 2 insertions(+), 1 deletion(-) diff --git a/tests/bats/fci.bats b/tests/bats/fci.bats index 6512d60b..447133ec 100644 --- a/tests/bats/fci.bats +++ b/tests/bats/fci.bats @@ -42,11 +42,12 @@ function run_FCI_ZMQ() { qp_set_mo_class h2o.ezfio -core "[1]" -act "[2-12]" -del "[13-24]" } @test "FCI H2O cc-pVDZ" { - run_FCI h2o.ezfio 2000 -76.1253758241716 -76.1258130146102 + run_FCI h2o.ezfio 2000 -76.125246738693903 -76.1258130146102 } + @test "FCI-ZMQ H2O cc-pVDZ" { run_FCI_ZMQ h2o.ezfio 2000 -76.1250552686394 -76.1258817228809 }