LCPQ/quantum_package
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170 Commits 6 Branches 5 Tags 93 MiB
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4 Commits

Author SHA1 Message Date
Manu
ce7ee6cc6f Fixed bug in FCI 2014-07-16 15:35:51 +02:00
Anthony Scemama
33e8f41268 Save wavefunction 2014-06-07 22:07:50 +02:00
Anthony Scemama
a451a89e5a Accelerated selection using dichotomy 2014-06-02 15:18:45 +02:00
Anthony Scemama
9897ba6c19 CISD selection + MP2 clean 2014-05-27 17:30:44 +02:00