From 6c7d94f403b16416f6224be1c17b74077f572644 Mon Sep 17 00:00:00 2001 From: Anthony Scemama Date: Wed, 18 Mar 2015 15:17:50 +0100 Subject: [PATCH] Modification for new EMSL API (>=0.8.1) --- scripts/get_basis.sh | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/scripts/get_basis.sh b/scripts/get_basis.sh index 0a21a2bf..d01324fe 100755 --- a/scripts/get_basis.sh +++ b/scripts/get_basis.sh @@ -30,7 +30,7 @@ then echo "ERROR" exit 1 fi -${EMSL_API_ROOT}/EMSL_api.py get_basis_data --save --path="${tmpfile}" --basis="${basis}" $atoms +${EMSL_API_ROOT}/EMSL_api.py get_basis_data --treat_l --save --path="${tmpfile}" --basis="${basis}" $atoms