|
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0f0bceb6c3
|
GWH guess
|
2023-06-26 15:37:05 +02:00 |
|
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|
bdece8ea60
|
Moving all MOs is not optimal
|
2021-02-03 10:47:34 +01:00 |
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254e8b5dc8
|
Pretty printer for localization
|
2021-02-03 09:31:11 +01:00 |
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32c09e5d14
|
Fixed localization
|
2021-02-03 08:50:52 +01:00 |
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8e99b4a58c
|
Fixed localization
|
2021-02-01 16:35:58 +01:00 |
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|
0b6fe42e55
|
Localization
|
2021-01-30 19:07:59 +01:00 |
|
|
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73a5cf6ca2
|
MP2 OK
|
2021-01-01 16:39:33 +01:00 |
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28e6fda242
|
Added frozen_core
|
2021-01-01 12:52:50 +01:00 |
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|
|
65d04a76f2
|
Cleaned readme for auto-generation
|
2020-12-28 12:23:39 +01:00 |
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|
|
3c27ec0c10
|
Added exponential of matrix
|
2020-12-17 12:55:11 +01:00 |
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51b1d0d002
|
Better tests
|
2020-12-07 14:12:35 +01:00 |
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|
|
74ae9acd1a
|
Fixed Huckel guess
|
2020-10-26 13:35:06 +01:00 |
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|
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04d9e14470
|
Added Hartree_Fock
|
2020-10-18 01:58:22 +02:00 |
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16adf48234
|
Introduced infix operators for Vector and Matrices
|
2020-10-17 19:02:37 +02:00 |
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