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Commit Graph

5 Commits

Author SHA1 Message Date
e3fff202b8 Added MD5 key in AOs for check in MOs 2014-12-26 00:17:34 +01:00
ff86d51c5f Hartree-Fock works well 2014-06-25 14:58:58 +02:00
89a7e3a644 DIIS on the way... 2014-06-19 17:58:45 +02:00
65cef0f6e6 Documented MOs 2014-04-10 22:27:05 +02:00
a89f032e15 Added MOs and bitmasks 2014-04-03 01:59:48 +02:00