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All_singles
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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analyze_wf
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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CAS_SD
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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CAS_SD_ZMQ
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Conditional compiling for ZMQ_PUSH
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2017-05-16 16:31:35 +02:00 |
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Casino
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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CASSCF
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Distributed PT2
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2016-02-19 00:20:28 +01:00 |
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CID
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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CID_SC2_selected
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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CID_selected
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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CIS
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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CISD
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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CISD_SC2_selected
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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CISD_selected
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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DDCI_selected
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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DensityMatrix
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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DFT_Utils
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Revert "merge with main branch"
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2017-04-20 08:48:06 +02:00 |
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Dressed_Ref_Hamiltonian
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Added OVB_effective_Hamiltonian
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2016-02-17 12:22:45 +01:00 |
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FCIdump
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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FOBOCI
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Revert "merge with main branch"
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2017-04-20 08:48:06 +02:00 |
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Full_CI
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Adjusted send/receive buffers
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2017-05-04 23:36:10 +02:00 |
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Full_CI_ZMQ
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Set HWM to 1 in ZMQ
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2017-05-18 14:11:22 +02:00 |
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Generators_CAS
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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Generators_full
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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Generators_restart
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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Hartree_Fock
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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loc_cele
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Fixed for new IRPF90
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2017-05-16 16:58:24 +02:00 |
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Molden
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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MP2
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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MRCC_Utils
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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mrcepa0
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Fixed for new IRPF90
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2017-05-16 16:58:24 +02:00 |
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MRPT
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Revert "Bugs to fix (#50)" (#51)
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2017-04-20 08:45:56 +02:00 |
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MRPT_Utils
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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Orbital_Entanglement
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Added the Orbital Entanglement plugin, added the list of active orbitals in bitmasks.irp.f.
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2016-02-12 12:27:13 +01:00 |
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OVB
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added print_hcc and OVB plugin
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2016-02-17 10:52:57 +01:00 |
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OVB_effective_Hamiltonian
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Added OVB_effective_Hamiltonian
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2016-02-17 12:22:45 +01:00 |
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Perturbation
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Merge
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2017-04-21 23:33:35 +02:00 |
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Properties
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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Psiref_CAS
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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Psiref_Utils
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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QmcChem
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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qmcpack
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Merge Anouar (#53)
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2017-04-21 22:34:25 +02:00 |
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read_integral
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Add plugings to read the Molecular integrals
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2017-05-08 16:38:51 +00:00 |
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Selectors_CASSD
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Fixed selection slave
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2016-11-16 15:18:24 +01:00 |
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Selectors_full
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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Selectors_no_sorted
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
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SingleRefMethod
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Merged scemama-master
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2017-04-20 19:18:16 +02:00 |
