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All_singles
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Python2
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2018-05-02 19:52:23 +02:00 |
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analyze_wf
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analyze_wf
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2018-04-09 18:34:45 +02:00 |
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Bk
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Fixed reading MOs
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2018-05-07 23:30:32 +02:00 |
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CAS_SD_ZMQ
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Moved DavidsonDressed in plugins
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2018-02-19 15:14:17 +01:00 |
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Casino
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Moved DavidsonDressed in plugins
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2018-02-19 15:14:17 +01:00 |
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CID
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Python2
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2018-05-02 19:52:23 +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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Python2
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2018-05-02 19:52:23 +02:00 |
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CIS
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Python2
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2018-05-02 19:52:23 +02:00 |
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CISD
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Python2
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2018-05-02 19:52:23 +02:00 |
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CISD_SC2_selected
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Python2
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2018-05-02 19:52:23 +02:00 |
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CISD_selected
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Python2
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2018-05-02 19:52:23 +02:00 |
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DavidsonDressed
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Barycentric
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2018-05-07 15:21:28 +02:00 |
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DensityMatrix
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Removed aligns
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2017-11-27 10:58:32 +01:00 |
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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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dress_zmq
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truncate_wf_spin
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2018-05-07 15:51:02 +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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Python2
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2018-05-02 19:52:23 +02:00 |
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FourIdx
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Fixed Slater's Rules
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2017-10-05 18:48:38 +02:00 |
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Full_CI
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Python2
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2018-05-02 19:52:23 +02:00 |
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Full_CI_ZMQ
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Optimized MPI
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2018-06-07 19:26:57 +02:00 |
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Full_CI_ZMQ_GPI2
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Working on GPI2
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2017-07-22 13:33:28 +02:00 |
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Generators_CAS
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Fixed Generators_CAS
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2018-05-24 14:12:25 +02:00 |
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Generators_full
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Fixed multi-state
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2018-01-10 18:55:08 +01:00 |
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Generators_restart
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Fixed travis
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2018-01-05 18:15:34 +01:00 |
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GPI2
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Fixes #223
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2018-01-12 21:42:37 +01:00 |
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Hartree_Fock
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Merge branch 'master' of github.com:scemama/quantum_package
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2018-01-10 19:11:08 +01:00 |
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Hartree_Fock_SlaterDressed
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Removed aligns
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2017-11-27 10:58:32 +01:00 |
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loc_cele
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Modifs Manus
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2017-10-27 12:20:00 +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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Python2
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2018-05-02 19:52:23 +02:00 |
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MR_wf_analysis
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Modifs Manus
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2017-10-27 12:20:00 +02:00 |
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mrcc_sto
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Merge branch 'alpha_factory' of https://github.com/garniron/quantum_package into garniron-alpha_factory
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2018-03-05 17:26:43 +01:00 |
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MRCC_Utils
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Python2
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2018-05-02 19:52:23 +02:00 |
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mrcepa0
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S2
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2018-05-24 16:19:27 +02:00 |
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MRPT
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Moved DavidsonDressed in plugins
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2018-02-19 15:14:17 +01:00 |
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MRPT_Utils
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Python2
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2018-05-02 19:52:23 +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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Python2
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2018-05-02 19:52:23 +02:00 |
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Properties
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Moved DavidsonDressed in plugins
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2018-02-19 15:14:17 +01:00 |
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Psiref_CAS
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Fixed Travis
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2018-02-27 19:13:31 +01:00 |
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Psiref_Utils
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Added Bk module
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2018-03-05 17:04:26 +01:00 |
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pyscf
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python2
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2018-05-07 23:43:35 +02:00 |
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QMC
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Merge branch 'master' of github.com:scemama/quantum_package
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2018-05-07 15:51:07 +02:00 |
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read_integral
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Merge Anouar (#69)
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2018-05-07 12:06:25 +02:00 |
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Selectors_CASSD
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Comment to clarify Selectors_CASSD
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2018-02-28 16:12:46 +01:00 |
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Selectors_full
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Removed output variables
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2018-01-05 14:38:32 +00:00 |
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Selectors_no_sorted
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Fixed travis
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2018-01-05 18:15:34 +01:00 |
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Selectors_Utils
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Removed output variables
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2018-01-05 14:38:32 +00:00 |
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shiftedbk
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Barycentric
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2018-05-07 15:21:28 +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 |
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Symmetry
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Fixed travis
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2018-01-05 18:15:34 +01:00 |
