Anthony Scemama 627d405e54 Default level shift is 0.5 au

2015-11-27 09:03:03 +01:00

..

Alavi

Epic merge for the doc...

2015-07-16 15:44:51 +02:00

CAS_SD

Added CAS+S

2015-11-25 11:49:42 +01:00

Casino

Epic merge for the doc...

2015-07-16 15:44:51 +02:00

CID

Shells in README

2015-11-08 21:37:50 +01:00

CID_SC2_selected

Epic merge for the doc...

2015-07-16 15:44:51 +02:00

CID_selected

Epic merge for the doc...

2015-07-16 15:44:51 +02:00

CIS

CISD save energy

2015-09-11 15:30:44 +02:00

CISD

Shells in README

2015-11-08 21:37:50 +01:00

CISD_SC2_selected

Shells in README

2015-11-08 21:37:50 +01:00

CISD_selected

Shells in README

2015-11-08 21:37:50 +01:00

DDCI_selected

Shells in README

2015-11-08 21:37:50 +01:00

DensityMatrix

Fix README and graphiz

2015-07-16 10:40:57 +02:00

FCIdump

Added target_pt2_qmc

2015-10-19 17:28:08 +02:00

Full_CI

Shells in README

2015-11-08 21:37:50 +01:00

Generators_CAS

minilist primitive/tri par alpha en cours

2015-10-16 13:06:19 +02:00

Generators_full

Added target_pt2_qmc

2015-10-19 17:28:08 +02:00

Generators_restart

Fix README and graphiz

2015-07-16 10:40:57 +02:00

Hartree_Fock

Default level shift is 0.5 au

2015-11-27 09:03:03 +01:00

loc_cele

Shells in README

2015-11-08 21:37:50 +01:00

Molden

Update readme

2015-11-08 21:02:55 +01:00

MP2

Added EZFIO.cfg of MP2 module

2015-11-25 10:36:10 +01:00

MRCC_CASSD

Update readme

2015-11-08 21:02:55 +01:00

MRCC_Utils

README

2015-11-25 03:05:49 +01:00

MRCC_Utils_new

Changed psi_svd into psi_bilinear

2015-07-30 16:05:28 +02:00

Perturbation

Merge eos:/users/p0510/caffarel/quantum_package

2015-11-25 18:08:40 +01:00

Properties

Added target_pt2_qmc

2015-10-19 17:28:08 +02:00

Psiref_CAS

Added target_pt2_qmc

2015-10-19 17:28:08 +02:00

Psiref_threshold

Cleaned MRCC in MRCC_Utils

2015-07-13 18:00:38 +02:00

Psiref_Utils

Added target_pt2_qmc

2015-10-19 17:28:08 +02:00

QmcChem

Print in QMC

2015-11-16 20:14:25 +01:00

Selectors_full

Added target_pt2_qmc

2015-10-19 17:28:08 +02:00

Selectors_no_sorted

Fix README and graphiz

2015-07-16 10:40:57 +02:00

SingleRefMethod

Added target_pt2_qmc

2015-10-19 17:28:08 +02:00