10
1
mirror of https://gitlab.com/scemama/QCaml.git synced 2024-07-16 08:00:22 +02:00
QCaml/MOBasis
2020-09-25 16:00:20 +02:00
..
.merlin Merlin 2020-05-05 00:29:00 +02:00
HF12.ml mu_erf propagated from input 2020-05-08 01:12:31 +02:00
Localisation.ml Removed Schwartz screening 2020-09-25 16:00:20 +02:00
MOBasis.ml Working n multipole integrals 2020-04-19 18:38:14 +02:00
MOBasis.mli functions ao<->mo 2020-04-30 10:11:10 +02:00
MOClass.ml map optimizations 2020-03-26 17:43:11 +01:00
MOClass.mli Added frozen-core option to run 2020-01-13 11:39:40 +01:00