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All_singles
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Beginning the merge with qp old
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2015-06-29 10:35:29 +02:00 |
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CAS_SD
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MRCC is ok with selected excitation operators
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2015-07-20 14:19:11 +02:00 |
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Casino
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Add Casino module
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2015-07-02 09:55:41 +02:00 |
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CID
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Modify gitignore
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2015-06-25 16:52:08 +02:00 |
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CID_SC2_selected
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Modify gitignore
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2015-06-25 16:52:08 +02:00 |
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CID_selected
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Modify gitignore
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2015-06-25 16:52:08 +02:00 |
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CIS
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Modify gitignore
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2015-06-25 16:52:08 +02:00 |
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CISD
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MRCC is ok with selected excitation operators
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2015-07-20 14:19:11 +02:00 |
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CISD_SC2_selected
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MRCC is ok with selected excitation operators
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2015-07-20 14:19:11 +02:00 |
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CISD_selected
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MRCC is ok with selected excitation operators
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2015-07-20 14:19:11 +02:00 |
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DDCI_selected
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MRCC is ok with selected excitation operators
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2015-07-20 14:19:11 +02:00 |
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DensityMatrix
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Move into plugins
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2015-06-17 18:23:56 +02:00 |
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FCIdump
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Modify gitignore
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2015-06-25 16:52:08 +02:00 |
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Full_CI
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MRCC is ok with selected excitation operators
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2015-07-20 14:19:11 +02:00 |
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Generators_CAS
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MRCC is ok with selected excitation operators
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2015-07-20 14:19:11 +02:00 |
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Generators_full
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MRCC is ok with selected excitation operators
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2015-07-20 14:19:11 +02:00 |
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Generators_restart
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Beginning the merge with qp old
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2015-06-29 10:35:29 +02:00 |
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Hartree_Fock
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Merge branch 'master' of github.com:eginer/quantum_package
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2015-07-20 14:39:58 +02:00 |
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loc_cele
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MRCC is ok with selected excitation operators
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2015-07-20 14:19:11 +02:00 |
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Molden
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MRCC is ok with selected excitation operators
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2015-07-20 14:19:11 +02:00 |
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MP2
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Modify gitignore
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2015-06-25 16:52:08 +02:00 |
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MRCC_CASSD
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MRCC is ok with selected excitation operators
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2015-07-20 14:19:11 +02:00 |
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MRCC_Utils
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MRCC is ok with selected excitation operators
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2015-07-20 14:19:11 +02:00 |
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MRCC_Utils_new
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MRCC_Utils_new seems to work, but not sure
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2015-07-28 16:41:02 +02:00 |
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Perturbation
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MRCC is ok with selected excitation operators
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2015-07-20 14:19:11 +02:00 |
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Properties
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Cleaned MRCC in MRCC_Utils
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2015-07-13 18:00:38 +02:00 |
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Psiref_CAS
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Cleaned MRCC in MRCC_Utils
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2015-07-13 18:00:38 +02:00 |
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Psiref_threshold
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Cleaned MRCC in MRCC_Utils
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2015-07-13 18:00:38 +02:00 |
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Psiref_Utils
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MRCC is ok with selected excitation operators
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2015-07-20 14:19:11 +02:00 |
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QmcChem
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Cleaned MRCC in MRCC_Utils
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2015-07-13 18:00:38 +02:00 |
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Selectors_full
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Cleaned MRCC in MRCC_Utils
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2015-07-13 18:00:38 +02:00 |
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Selectors_no_sorted
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Move into plugins
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2015-06-17 18:23:56 +02:00 |
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SingleRefMethod
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MRCC converges with tiny matrixes
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2015-07-03 19:19:44 +02:00 |
