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Commit Graph

12 Commits

Author SHA1 Message Date
4e65d70a52 Improved parallel 2019-02-28 22:21:54 +01:00
ac45b0b0cb Cleaning 2019-02-28 19:37:54 +01:00
bb677d4f3a Accelerated CI 2019-02-28 19:03:01 +01:00
e1aafcbd32 spin fci 2019-02-28 16:55:50 +01:00
5afd6f8f82 Determinant stream 2019-02-28 14:25:57 +01:00
355aa9f166 Using less memory 2019-02-28 12:50:42 +01:00
a976bacfdf Davidson with sparse matrix 2019-02-28 12:34:07 +01:00
1bff2c9fcc Davidson works 2019-02-27 14:56:59 +01:00
b83b23913e ROHF OK 2019-02-26 12:05:14 +01:00
4452d445f5 Working on parallelism 2019-02-25 14:37:20 +01:00
ecf61058f9 S2 is programmed in CI 2019-02-22 19:19:11 +01:00
f2794fa54e FCI OK 2019-02-22 00:18:32 +01:00