increase tol

svn-origin-rev: 18411
This commit is contained in:
Alfio Lazzaro 2018-05-02 08:14:41 +00:00
parent 0ceed53270
commit 82158e9da8

View file

@ -1,5 +1,5 @@
C-HF-q4.inp 56 1.e-06 0.0493502097
H-B3LYP-q1.inp 56 1.e-07 2.5421529413
H-B3LYP-q1.inp 56 2.e-07 2.5421529413
O-B97-q6.inp 56 1.e-06 0.0006817002
O-PBE0-q6.inp 56 1e-06 2055.4453718494
O_KG.inp 61 5e-04 0.9385713054E-01