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Commit Graph

72 Commits

Author SHA1 Message Date
8993c168d6 Introducing tuples 2018-02-02 11:42:40 +01:00
49c503fa55 Optimization 2018-02-02 01:25:10 +01:00
fb8fff6ee1 Optimization 2018-02-02 00:04:35 +01:00
938e9c18fb Fixed 2018-02-01 17:46:10 +01:00
ffc2138419 Merge branch 'master' of lpqlx139:/home/scemama/NewQP 2018-02-01 17:44:19 +01:00
a586ccc434 Fixed norm inefficiency 2018-02-01 17:14:34 +01:00
f3d03cd424 Accelerated norm function 2018-02-01 16:09:04 +01:00
148052025c Array of m 2018-01-31 14:37:51 +01:00
803fa3a0d9 Added print: 2018-01-30 22:36:17 +01:00
9c9fc0a9e6 Small optimizations 2018-01-30 14:51:37 +01:00
8c8ea8363a Fixed 2018-01-24 16:34:50 +01:00
5cc48e59d7 Accelerated HRR and VRR 2018-01-24 16:29:48 +01:00
e9c0a8d0db Working on ERI 2018-01-24 02:14:37 +01:00
e0c0ec1353 Schwartz 2018-01-23 19:26:28 +01:00
a20b22dab7 Preparation of Schwartz screening 2018-01-23 00:48:45 +01:00
4a4809fc7e Inserted overlap 2018-01-22 23:19:24 +01:00
ce59acc326 Working on 1e integrals 2018-01-22 15:27:41 +01:00
e4786b7765 Optimized Zkey 2018-01-20 12:10:32 +01:00
1eadca79b3 Minimal screening 2018-01-20 01:49:50 +01:00
0e694adf84 Cleaning 2018-01-19 18:18:11 +01:00
73c8e48731 Optimized ERIs 2018-01-19 03:14:06 +01:00
932d5859fe General RR module 2018-01-18 23:42:48 +01:00