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84e01bfcb6
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-w
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2020-06-11 15:36:16 +02:00 |
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10e316b140
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gitignore
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2020-06-10 15:40:44 +02:00 |
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04d5f4a592
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gitignore
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2020-06-10 15:34:49 +02:00 |
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b6bbeb3f3b
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fix bug in BSE triplet
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2020-06-09 21:24:37 +02:00 |
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da8ef4fa5b
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new examples
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2020-06-07 09:59:36 +02:00 |
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fdaf483399
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fix bug
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2020-06-06 21:34:39 +02:00 |
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d473dd79fa
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BSE2
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2020-06-06 08:48:04 +02:00 |
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769f4e9221
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(1)
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2020-06-05 22:34:32 +02:00 |
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bf7f441d4d
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RCC
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2020-06-04 22:41:38 +02:00 |
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bd6684e876
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Merge branch 'master' of github.com:pfloos/quack
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2020-06-04 22:40:45 +02:00 |
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986caedeac
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clean dBSE code
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2020-06-04 22:40:14 +02:00 |
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Anthony Scemama
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15f65c7010
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Merge pull request #2 from pfloos/add-license-1
Create LICENSE
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2020-06-04 18:36:17 +02:00 |
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Anthony Scemama
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e88df333cf
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Create LICENSE
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2020-06-04 18:35:51 +02:00 |
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2d02a4b694
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new basis
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2020-06-04 13:08:31 +02:00 |
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e4ce9dd9ba
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stop
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2020-06-03 12:46:26 +02:00 |
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8fd57515cc
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bug fix evGF2
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2020-06-03 12:24:38 +02:00 |
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4b3bb88b84
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clean up GF
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2020-06-03 12:06:16 +02:00 |
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ea78befb4f
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BSE2 debug done
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2020-06-02 22:36:56 +02:00 |
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a011b3dfde
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fix TDA
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2020-06-02 13:24:40 +02:00 |
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862314e414
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BSE2
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2020-06-02 13:20:20 +02:00 |
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434d5e9c52
|
BSE almost done
|
2020-06-01 22:01:53 +02:00 |
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29294ef5a4
|
BSE almost done
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2020-06-01 22:01:21 +02:00 |
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b72a23fc98
|
BSE2
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2020-06-01 17:30:02 +02:00 |
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9a0c7bfac7
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problem minus sign
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2020-06-01 17:26:52 +02:00 |
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96207d9c58
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problem minus sign solved
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2020-06-01 17:14:42 +02:00 |
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503cd430ae
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non dTDA
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2020-06-01 11:36:50 +02:00 |
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030435f90c
|
non dTDA
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2020-06-01 11:35:17 +02:00 |
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a02bebdd88
|
iterative dynamic correction for BSE
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2020-05-21 16:13:52 +02:00 |
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629a166e03
|
beyond TDA for dynamic BSE
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2020-05-20 16:49:16 +02:00 |
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0c6153de3f
|
beyond TDA for dynamic BSE
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2020-05-20 16:46:07 +02:00 |
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61832f1259
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GW gap warning and antiresonnant term
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2020-05-15 13:08:07 +02:00 |
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431eab634d
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saving eDFT
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2020-05-05 16:45:10 +02:00 |
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d91631f73f
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Done with 3st ensemble
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2020-04-27 23:04:00 +02:00 |
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2ce6b12854
|
Three-state extension and MOM
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2020-04-26 23:17:27 +02:00 |
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54a938a909
|
switch to eDFT
|
2020-04-26 16:07:45 +02:00 |
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2b44f1b294
|
more examples
|
2020-04-23 23:14:14 +02:00 |
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f38c07a444
|
dynamic screening in BSE
|
2020-04-23 23:13:44 +02:00 |
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01e9f785c2
|
dynamic screening in BSE
|
2020-04-23 23:13:15 +02:00 |
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e855727d8a
|
dyn corr for BSE
|
2020-04-22 09:55:58 +02:00 |
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a2c2eb32b5
|
dynamic correction
|
2020-04-22 00:39:52 +02:00 |
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13b170fc2f
|
star implementation of CISD
|
2020-04-20 12:28:19 +02:00 |
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88c13a8ec9
|
more examples
|
2020-04-16 17:02:57 +02:00 |
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2b0244e010
|
RS in GW
|
2020-04-16 17:02:01 +02:00 |
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a0b8383971
|
correct bug in evGW
|
2020-04-15 09:34:41 +02:00 |
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b5e4ded668
|
cleaning ppRPA
|
2020-04-15 08:53:02 +02:00 |
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cfc910fb26
|
lr from Toto
|
2020-04-14 15:59:34 +02:00 |
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5441aa845a
|
bug print
|
2020-04-13 23:05:19 +02:00 |
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8433bf9281
|
bug print
|
2020-04-13 22:56:49 +02:00 |
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57003acb75
|
faster orthogonalization in ppRPA
|
2020-04-13 20:13:38 +02:00 |
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2f835304f7
|
evGT
|
2020-04-13 14:19:14 +02:00 |
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