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2,823 Commits 6 Branches 5 Tags 93 MiB
9d84d403c9
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26 Commits

Author SHA1 Message Date
Anthony Scemama
9d84d403c9 Merge branch 'alpha_factory' of https://github.com/garniron/quantum_package into garniron-alpha_factory 2018-05-18 10:26:26 +02:00
Yann Garniron
f45fc46b4f multistate shifted_bk 2018-05-17 16:02:51 +02:00
Yann Garniron
7cc33f1ab3 shifted-bk selection iterates 2018-05-14 13:00:04 +02:00
Yann Garniron
9823fed7be merged with master 2018-05-09 15:03:31 +02:00
Anthony Scemama
4e55e36260 Barycentric 2018-05-07 15:21:28 +02:00
Yann Garniron
d5f66787fe real(4) dressing restored 2018-05-02 14:32:41 +02:00
Yann Garniron
274bb043c2 reduce tasks 2018-04-27 12:41:39 +02:00
Anthony Scemama
85bb6ac5f4 Added barycentric PT 2018-04-12 15:49:41 +02:00
Anthony Scemama
f3a79c2316 Barycentric energy 2018-04-12 15:29:44 +02:00
Yann Garniron
46450f0826 compute sum of alpha2 2018-04-10 14:25:28 +02:00
Yann Garniron
2e3c54e278 fixed custom buffers 2018-04-04 11:32:27 +02:00
Yann Garniron
4aa4c6c96e custom buffers in dress_zmq 2018-03-30 18:22:14 +02:00
Yann Garniron
4394c04728 reduced bandwidth and checkpoint updates 2018-03-27 16:22:14 +02:00
Yann Garniron
a865a842d2 undressing with s2_eig 2018-03-26 13:08:26 +02:00
Anthony Scemama
af1c600a53 Added shifted_bk_slave 2018-03-26 12:06:18 +02:00
Anthony Scemama
5a8ab847b9 Multistate dressing OK 2018-03-23 13:47:47 +01:00
Yann Garniron
611137fad0 undressing without s2_eig 2018-03-23 11:06:52 +01:00
Yann Garniron
2bf17db149 unfinished shifted_bk stochastic selection - no undressing 2018-03-22 14:07:20 +01:00
Yann Garniron
c786e9fe58 shifted_bk_slave 2018-03-21 12:06:26 +01:00
Anthony Scemama
437df9439d
corrected bitmask in Full_CI_ZMQ - seemingly working shiftedbk (#68) 
* corrected bitmask in Full_CI_ZMQ - seemingly working shiftedbk

* removed set_generators_bitmasks_as_holes_and_particles from dress_zmq

* removed dress_zmq dependency to MRCC_Utils
 2018-03-20 13:11:53 +01:00
Yann Garniron
a3d7954faf removed dress_zmq dependency to MRCC_Utils 2018-03-20 12:08:09 +01:00
Yann Garniron
9ca7b74362 removed set_generators_bitmasks_as_holes_and_particles from dress_zmq 2018-03-20 11:54:37 +01:00
Yann Garniron
ade11beb25 corrected bitmask in Full_CI_ZMQ - seemingly working shiftedbk 2018-03-15 17:47:32 +01:00
Anthony Scemama
5dabd614f8 Bk 2018-03-07 19:01:19 +01:00
Yann Garniron
bc626377f3 shiftedbk not working - may be removed later 2018-03-05 12:43:31 +01:00
Yann Garniron
1a0f36dfa5 init shiftedbk 2018-03-02 15:29:58 +01:00