From 51a590e8754e5196e48c3841fe62b314802e4089 Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?Micka=C3=ABl=20V=C3=A9ril?= Date: Mon, 16 Sep 2019 09:52:57 +0200 Subject: [PATCH] Fix exFCI --- static/data/water_aug-cc-pVDZ_exFCI.dat | 2 +- static/data/water_aug-cc-pVTZ_exFCI.dat | 2 +- 2 files changed, 2 insertions(+), 2 deletions(-) diff --git a/static/data/water_aug-cc-pVDZ_exFCI.dat b/static/data/water_aug-cc-pVDZ_exFCI.dat index 54735341..8637cd94 100644 --- a/static/data/water_aug-cc-pVDZ_exFCI.dat +++ b/static/data/water_aug-cc-pVDZ_exFCI.dat @@ -1,6 +1,6 @@ # title : Water # code : -# method : CC3 +# method : exFCI # basis : aug-cc-pVDZ,gaussian # doi : 10.1021/acs.jctc.8b00406 diff --git a/static/data/water_aug-cc-pVTZ_exFCI.dat b/static/data/water_aug-cc-pVTZ_exFCI.dat index 9d3d8f13..3983fd9e 100644 --- a/static/data/water_aug-cc-pVTZ_exFCI.dat +++ b/static/data/water_aug-cc-pVTZ_exFCI.dat @@ -1,6 +1,6 @@ # title : Water # code : -# method : CCSDTQ +# method : exFCI # basis : aug-cc-pVTZ,gaussian # doi : 10.1021/acs.jctc.8b00406