From da03128481adf8f78a8a04ebeae0490480c03b89 Mon Sep 17 00:00:00 2001 From: Joshua Edzards <89650372+Scemp@users.noreply.github.com> Date: Tue, 15 Apr 2025 12:18:29 +0200 Subject: [PATCH] Update BASIS_MOLOPT_UZH (#4140) --- data/BASIS_MOLOPT_UZH | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/data/BASIS_MOLOPT_UZH b/data/BASIS_MOLOPT_UZH index da0116d4e8..ce34df311e 100644 --- a/data/BASIS_MOLOPT_UZH +++ b/data/BASIS_MOLOPT_UZH @@ -3702,7 +3702,7 @@ Rb DZVP-MOLOPT-SCAN-GTH-q9 DZVP-MOLOPT-MGGA-GTH-q9 # Strontium ############################################################################################################################# -r TZV2P-MOLOPT-SCAN-GTH-q10 TZV2P-MOLOPT-MGGA-GTH-q10 +Sr TZV2P-MOLOPT-SCAN-GTH-q10 TZV2P-MOLOPT-MGGA-GTH-q10 1 2 0 2 6 4 3 1 15.72822083687552 5.45893238317751E-03 2.20046069268328E-02 -1.34290989900533E-02 -4.02237984998042E-02 2.30712863924787E-02 -5.82756648298795E-04 -4.31840091890549E-02 5.39407807914309E-04