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quantum_package/plugins
History
TApplencourt 7a455d8fd6 Add plugings to read the Molecular integrals
2017-05-08 16:38:51 +00:00
..
All_singles
Merged scemama-master
2017-04-20 19:18:16 +02:00
analyze_wf
Inactives deactivated in MRCC
2017-04-13 00:47:44 +02:00
CAS_SD
Merged scemama-master
2017-04-20 19:18:16 +02:00
CAS_SD_ZMQ
Cleaned correlation_energy_ratio_max
2017-04-21 23:14:38 +02:00
Casino
Merged scemama-master
2017-04-20 19:18:16 +02:00
CASSCF
Distributed PT2
2016-02-19 00:20:28 +01:00
CID
Merged scemama-master
2017-04-20 19:18:16 +02:00
CID_SC2_selected
Merged scemama-master
2017-04-20 19:18:16 +02:00
CID_selected
Merged scemama-master
2017-04-20 19:18:16 +02:00
CIS
Merged scemama-master
2017-04-20 19:18:16 +02:00
CISD
Merged scemama-master
2017-04-20 19:18:16 +02:00
CISD_SC2_selected
Merged scemama-master
2017-04-20 19:18:16 +02:00
CISD_selected
Merged scemama-master
2017-04-20 19:18:16 +02:00
DDCI_selected
Merged scemama-master
2017-04-20 19:18:16 +02:00
DensityMatrix
Merged scemama-master
2017-04-20 19:18:16 +02:00
DFT_Utils
Revert "merge with main branch"
2017-04-20 08:48:06 +02:00
Dressed_Ref_Hamiltonian
Added OVB_effective_Hamiltonian
2016-02-17 12:22:45 +01:00
FCIdump
Merged scemama-master
2017-04-20 19:18:16 +02:00
FOBOCI
Revert "merge with main branch"
2017-04-20 08:48:06 +02:00
Full_CI
Merged scemama-master
2017-04-20 19:18:16 +02:00
Full_CI_ZMQ
Cleaned correlation_energy_ratio_max
2017-04-21 23:14:38 +02:00
Generators_CAS
Merged scemama-master
2017-04-20 19:18:16 +02:00
Generators_full
Merged scemama-master
2017-04-20 19:18:16 +02:00
Generators_restart
Merged scemama-master
2017-04-20 19:18:16 +02:00
Hartree_Fock
Merged scemama-master
2017-04-20 19:18:16 +02:00
loc_cele
Merged scemama-master
2017-04-20 19:18:16 +02:00
Molden
Merged scemama-master
2017-04-20 19:18:16 +02:00
MP2
Merged scemama-master
2017-04-20 19:18:16 +02:00
MRCC_Utils
Merged scemama-master
2017-04-20 19:18:16 +02:00
mrcepa0
Merged scemama-master
2017-04-20 19:18:16 +02:00
MRPT
Revert "merge with main branch"
2017-04-20 08:48:06 +02:00
MRPT_Utils
Merged scemama-master
2017-04-20 19:18:16 +02:00
Orbital_Entanglement
Added the Orbital Entanglement plugin, added the list of active orbitals in bitmasks.irp.f.
2016-02-12 12:27:13 +01:00
OVB
added print_hcc and OVB plugin
2016-02-17 10:52:57 +01:00
OVB_effective_Hamiltonian
Added OVB_effective_Hamiltonian
2016-02-17 12:22:45 +01:00
Perturbation
Merge
2017-04-21 23:33:35 +02:00
Properties
Merged scemama-master
2017-04-20 19:18:16 +02:00
Psiref_CAS
Merged scemama-master
2017-04-20 19:18:16 +02:00
Psiref_Utils
Merged scemama-master
2017-04-20 19:18:16 +02:00
QmcChem
Merged scemama-master
2017-04-20 19:18:16 +02:00
qmcpack
Fix THE QMCPACK Determinant print
2017-04-21 09:44:26 -05:00
read_integral
Add plugings to read the Molecular integrals
2017-05-08 16:38:51 +00:00
Selectors_CASSD
Fixed selection slave
2016-11-16 15:18:24 +01:00
Selectors_full
Merged scemama-master
2017-04-20 19:18:16 +02:00
Selectors_no_sorted
Merged scemama-master
2017-04-20 19:18:16 +02:00
SingleRefMethod
Merged scemama-master
2017-04-20 19:18:16 +02:00