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mirror of https://github.com/QuantumPackage/qp2.git synced 2024-06-13 08:05:17 +02:00
Commit Graph

18 Commits

Author SHA1 Message Date
7033d61850 Small optimizations 2021-03-24 16:57:08 +01:00
Anthony Scemama
6683245273 Latest working CPU version 2021-03-24 15:08:33 +01:00
vijay gopal chilkuri
5db2680ed5 Looks like reduced loop works. 2021-03-17 15:34:22 +01:00
vijay gopal chilkuri
6e634b0779 Improved memory access in sigma_vector_cfg. 2021-03-15 14:22:08 +01:00
vijay gopal chilkuri
97a57594c3 Reduced memory for prototype matrix containers. 2021-03-12 15:50:54 +01:00
vijay gopal chilkuri
6486c89583 Fixed bug in sigma-vector-multi-state. 2021-03-12 12:57:04 +01:00
vijay gopal chilkuri
cf50f11f73 Optimized obtain_I_foralpha. 2021-03-12 11:28:56 +01:00
vijay gopal chilkuri
dd5b945c2a Added a naive function that stores the \alphas. 2021-03-12 11:03:59 +01:00
52c4fc1ce4 binary_search_cfg accelerated 2021-03-06 19:23:21 +01:00
vijay gopal chilkuri
2478f0863d Looks like everything is working. 2021-03-05 17:08:09 +01:00
v1j4y
c38d25fdba Working on sigma_vector for CFG-CI. 2021-03-01 18:28:45 +01:00
3c9944225c Removed useless function 2021-02-26 14:51:10 +01:00
832424aafa Merge branch 'csf' of github.com:QuantumPackage/qp2 into csf 2021-02-17 18:06:21 +01:00
f051750fd3 Minor changes 2021-02-17 18:05:49 +01:00
f381225425 Fixes for intel compiler 2021-02-17 15:58:16 +01:00
6c7b162ec5 Fix calculation of mem requirements 2021-02-17 15:49:58 +01:00
07bfa1cf70 Removed orthonormalization in Davidson 2021-02-17 15:35:10 +01:00
b87e87b740 First CSF davidson working 2021-02-17 14:59:25 +01:00