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Commit Graph

15 Commits

Author SHA1 Message Date
Abdallah Ammar
d919d6ce7d forked v 2022-07-05 01:17:43 +02:00
a0949cba45 Better error handling on ocaml
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2022-06-18 12:09:38 +02:00
2a98378fca Fix basis bugs when working on trexio 2021-12-30 14:43:14 +01:00
b2cb796d90 Removed debug prints 2021-12-10 18:43:05 +01:00
13eee57e67 Update for TREXIOv2 2021-12-07 19:30:32 +01:00
0bf0513fb1 Added VERSION file 2021-06-11 14:18:23 +02:00
63d407e4d2 Normalization in basis 2021-06-01 19:46:15 +02:00
1685e41258 Added basis module for easy export 2021-05-21 18:26:50 +02:00
68b33e4b35 Changed Symmetry into Angmom in OCaml 2021-05-21 16:42:48 +02:00
75891f14b7 Linear dependencies cutoff 2020-05-25 11:31:28 +02:00
ad8adda841 Documentation in configure 2020-02-04 19:04:36 +01:00
4dde03bf38 Allow negative charges in qp_create_ezfio 2019-11-26 14:27:48 +01:00
09eab3db06 Removed core 2019-03-13 15:49:57 +01:00
da3ba4ef4b Removed Core from qp_create_ezfio.ml 2019-03-13 11:35:21 +01:00
24d9745056 Initial commit 2019-01-25 11:39:31 +01:00