Emmanuel Giner c4ded9dcfb added basis correction and test		2020-04-06 15:06:16 +02:00
..
b2_stretched.zmt
be.xyz	added basis correction and test	2020-04-06 15:06:16 +02:00
c2h2.xyz
ch4.xyz
clf.xyz
clo.xyz
co2.xyz
cu_nh3_4_2plus.gms.out
dhno.xyz
f2.zmt
f.xyz	added basis correction and test	2020-04-06 15:06:16 +02:00
h2o2.zmt
h2o.log
h2s.xyz
h3coh.xyz
hbo.gms.out
hcn.xyz
hco.xyz
lif.xyz	added basis correction and test	2020-04-06 15:06:16 +02:00
n2_stretched.xyz	removed generators bitmaks, and casscf with not continuous orbital windows is working	2019-10-24 19:02:42 +02:00
n2.xyz
n2h4.zmt
nh3.xyz
o2_cas.gms.out	added basis correction and test	2020-04-06 15:06:16 +02:00
oh.xyz
sih2_3b1.xyz	Initial commit	2019-01-25 11:39:31 +01:00
sih3.xyz
so2.xyz
so.xyz