LCPQ/qp2
9
1
Fork 0
mirror of https://github.com/QuantumPackage/qp2.git synced 2025-04-28 19:24:46 +02:00
Code Releases Activity
qp2/src/casscf
History
Anthony Scemama d29f82c080 CAS-CI and wdens merged
2019-06-24 16:42:16 +02:00
..
bavard.irp.f
CAS-CI and wdens merged
2019-06-24 16:42:16 +02:00
bielec_create.irp.f
CAS-CI and wdens merged
2019-06-24 16:42:16 +02:00
casscf.irp.f
CAS-CI and wdens merged
2019-06-24 16:42:16 +02:00
class.irp.f
CAS-CI with no vvvv
2019-06-24 15:32:26 +02:00
densities.irp.f
CAS-CI and wdens merged
2019-06-24 16:42:16 +02:00
det_manip.irp.f
CAS-CI and wdens merged
2019-06-24 16:42:16 +02:00
driver_wdens.irp.f
CAS-CI and wdens merged
2019-06-24 16:42:16 +02:00
EZFIO.cfg
CAS-CI works
2019-06-24 15:37:09 +02:00
natorb.irp.f
CAS-CI and wdens merged
2019-06-24 16:42:16 +02:00
NEED
CAS-CI with no vvvv
2019-06-24 15:32:26 +02:00
README.rst
CAS-CI with no vvvv
2019-06-24 15:32:26 +02:00
save_energy.irp.f
CAS-CI works
2019-06-24 15:37:09 +02:00
tot_en.irp.f
CAS-CI and wdens merged
2019-06-24 16:42:16 +02:00

README.rst 

======
casscf
======

|CASSCF| program with the CIPSI algorithm.