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Commit Graph

11 Commits

Author SHA1 Message Date
Thomas Applencourt
acb6b7b16a Add NEED_CHILDREN_MODULE to replace NEEDED_MODULES 2015-04-30 18:56:04 +02:00
2204bc4aba Corrected CAS-SD bug 2015-04-02 11:40:16 +02:00
c8c64a76ff Renamed psi_generators in psi_det_generators 2015-04-02 10:26:45 +02:00
6b2496d0ed Lots of cleaning in scripts and Makefiles 2015-03-26 00:33:45 +01:00
9676f62674 A lot of cleaning. Removed CIS_dressed. 2015-01-15 14:00:00 +01:00
7fed44c5ad Started to introduce coarray Fortran in integrals 2014-07-10 02:33:46 +02:00
ff86d51c5f Hartree-Fock works well 2014-06-25 14:58:58 +02:00
dcd5a1274b Previous commit broke SingleRefMethod 2014-06-02 21:47:13 +02:00
9897ba6c19 CISD selection + MP2 clean 2014-05-27 17:30:44 +02:00
741cd36db2 Merge branch 'master' of github.com:LCPQ/quantum_package
Conflicts:
	src/CISD/README.rst
	src/CISD/SC2.irp.f
	src/CISD/cisd.irp.f
	src/Dets/README.rst
	src/Dets/determinants.irp.f
	src/Dets/slater_rules.irp.f
	src/Perturbation/README.rst
2014-05-24 03:29:35 +02:00
64a14b52e9 Selection and perturbation work. Introduced new tests. 2014-05-24 02:39:18 +02:00