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96e68c4b36
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clean up results and add a bit of conclusion
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2020-02-19 20:47:37 +01:00 |
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afc9862174
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new fig
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2020-02-19 14:53:07 +01:00 |
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d278d6f1aa
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res almost done
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2020-02-19 14:52:47 +01:00 |
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ecc77c9afc
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lots of changes
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2020-02-18 16:08:34 +01:00 |
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8b1d4c6ea2
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new graphs and SI
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2020-02-18 15:01:58 +01:00 |
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5869fd3790
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parentheses a Manu
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2020-02-18 12:32:15 +01:00 |
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37437c2f4d
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eHF res
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2020-02-17 23:24:51 +01:00 |
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3bc6578c2e
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E vs w
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2020-02-17 16:26:36 +01:00 |
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4a8ea81420
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add E vs w figure and text
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2020-02-17 15:52:53 +01:00 |
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17ba3b53ce
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new figure
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2020-02-16 18:05:39 +01:00 |
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b9a1b73ebf
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add eHF results to SI
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2020-02-16 14:26:23 +01:00 |
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0eca8d17b6
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minor corrections
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2020-02-16 13:54:08 +01:00 |
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51e238a824
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functional
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2020-02-15 22:25:09 +01:00 |
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09a8c90155
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Done with Theory
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2020-02-15 20:55:41 +01:00 |
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2c5191d49b
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dr at the end
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2020-02-15 18:07:35 +01:00 |
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88866a4207
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clean up intro and expand it a bit
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2020-02-15 18:00:58 +01:00 |
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0ad3fe75a9
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minors
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2020-02-15 16:17:44 +01:00 |
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56a27fa2e3
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donw 1st step cleaning
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2020-02-15 16:01:16 +01:00 |
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379dcd173d
|
continue cleaning
|
2020-02-15 14:16:56 +01:00 |
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1a50d6786d
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starting clean up
|
2020-02-14 22:41:41 +01:00 |
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6e5b179323
|
rought merge
|
2020-02-14 21:01:46 +01:00 |
|
Emmanuel Fromager
|
c4dc7b71a9
|
Manu: first global polishing done
|
2020-02-14 16:08:20 +01:00 |
|
Emmanuel Fromager
|
05d56f12d0
|
Manu: polished the theory and the approximations
|
2020-02-14 15:51:11 +01:00 |
|
Emmanuel Fromager
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20780fe96b
|
Manu: done with self-teaching. Will clean the all thing after lunch
|
2020-02-14 13:51:24 +01:00 |
|
Emmanuel Fromager
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3b9c09ce2e
|
Manu: saving work
|
2020-02-14 10:03:34 +01:00 |
|
Emmanuel Fromager
|
3a480b0adc
|
Manu: (hopefully) found proper notations for density matrices and Coulomb-exchange integrals
|
2020-02-13 20:18:16 +01:00 |
|
Emmanuel Fromager
|
005326057c
|
Manu: saving work
|
2020-02-13 18:43:40 +01:00 |
|
Emmanuel Fromager
|
32385987c3
|
Manu: saving work
|
2020-02-13 17:07:07 +01:00 |
|
Emmanuel Fromager
|
24b952668a
|
Manu: saving work
|
2020-02-13 15:08:24 +01:00 |
|
Emmanuel Fromager
|
f353ffa294
|
Manu: minor comment
|
2020-02-13 14:53:53 +01:00 |
|
Emmanuel Fromager
|
d3f688f2c9
|
Manu: just to be sure.
|
2020-02-13 14:49:46 +01:00 |
|
Emmanuel Fromager
|
35d651e7e6
|
Manu: first polishing
|
2020-02-13 14:48:47 +01:00 |
|
Emmanuel Fromager
|
cf45010298
|
Manu: first version of the theory section. Will polish the manuscript now
|
2020-02-13 11:05:53 +01:00 |
|
Emmanuel Fromager
|
d4e16e4b0e
|
Manu: saving work
|
2020-02-12 12:04:03 +01:00 |
|
Emmanuel Fromager
|
8be0c43be5
|
Manu: saving work
|
2020-02-11 16:25:39 +01:00 |
|
Emmanuel Fromager
|
bc03cae112
|
Manu: saving work
|
2020-02-11 15:00:44 +01:00 |
|
Emmanuel Fromager
|
3bf0fca3ad
|
Manu: saving work
|
2020-02-11 10:11:16 +01:00 |
|
Emmanuel Fromager
|
1184d379c3
|
Manu: saving work
|
2020-02-11 09:22:32 +01:00 |
|
Emmanuel Fromager
|
3f165a8bb8
|
Manu: first fully written version of the exact theory section
|
2020-02-05 18:26:44 +01:00 |
|
Emmanuel Fromager
|
4d5b0948a9
|
Manu: more on exact GOK-DFT
|
2020-02-04 17:27:24 +01:00 |
|
Emmanuel Fromager
|
11dfd3fc66
|
Manu: started polishing the theory section
|
2020-02-04 15:00:50 +01:00 |
|
Emmanuel Fromager
|
90a16fc541
|
Manu: started polishing the entire theory section
|
2019-10-30 13:38:08 +01:00 |
|
Emmanuel Fromager
|
8268c6a3b0
|
Manu: done with the final energy expressions
|
2019-10-30 13:21:29 +01:00 |
|
Emmanuel Fromager
|
04211afeae
|
Manu: saving work
|
2019-10-28 14:47:19 +01:00 |
|
Emmanuel Fromager
|
34607cf900
|
Manu: started polishing the theory. Saving work.
|
2019-10-11 12:43:35 +02:00 |
|
Emmanuel Fromager
|
89038f94fb
|
Manu: saving work
|
2019-09-18 21:48:44 +02:00 |
|
Emmanuel Fromager
|
cba8d0360a
|
Manu: saving work
|
2019-09-18 17:15:01 +02:00 |
|
Emmanuel Fromager
|
8a0b414989
|
Manu: saving work
|
2019-09-17 18:18:35 +02:00 |
|
Emmanuel Fromager
|
82cc67f680
|
Manu: started writing about the OEP-like scheme
|
2019-09-17 17:08:01 +02:00 |
|
|
1701e11803
|
cleanup SI
|
2019-09-17 16:55:16 +02:00 |
|
|
fffc333799
|
Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/eDFT_FUEG
|
2019-09-11 22:30:57 +02:00 |
|
Emmanuel Fromager
|
904a90aacc
|
Manu: added some notes to explain the final energy expressions
|
2019-09-11 20:32:23 +02:00 |
|
Emmanuel Fromager
|
ec2df6a680
|
Manu: now use the notation w_K
|
2019-09-11 19:37:09 +02:00 |
|
|
fc67e9c900
|
Merge branch 'master' of https://git.irsamc.ups-tlse.fr/loos/eDFT_FUEG
|
2019-09-11 19:35:03 +02:00 |
|
Emmanuel Fromager
|
420a464a6f
|
Manu: gave the final expression for the individual energies
|
2019-09-11 18:26:57 +02:00 |
|
Emmanuel Fromager
|
7c1eacafa5
|
Manu: saving work
|
2019-09-11 17:06:39 +02:00 |
|
Emmanuel Fromager
|
fd28576442
|
Manu: saving work
|
2019-09-11 12:49:00 +02:00 |
|
|
382a6001c2
|
minor modifications in SI
|
2019-09-11 09:38:41 +02:00 |
|
Emmanuel Fromager
|
7ae8c41498
|
Manu: derived the hopefully proper expression for the individual Hx energy
|
2019-09-10 18:35:14 +02:00 |
|
Emmanuel Fromager
|
0d01c4376d
|
Manu: saving work
|
2019-09-10 17:10:12 +02:00 |
|
Emmanuel Fromager
|
c1f4eb75df
|
Manu: started polishing the exact theory part
|
2019-09-10 13:13:01 +02:00 |
|
Emmanuel Fromager
|
2d35b5a523
|
Manu: replaced bar by overline
|
2019-09-10 11:42:11 +02:00 |
|
Emmanuel Fromager
|
db5360d99f
|
Manu: copy paste from the SI (to be polished)
|
2019-09-09 16:11:21 +02:00 |
|
|
5132d732ce
|
Theory section done
|
2019-09-09 11:56:53 +02:00 |
|
|
1da978e486
|
Theory section done
|
2019-09-09 11:44:30 +02:00 |
|
|
6766543ef0
|
work under progress
|
2019-09-06 17:26:37 +02:00 |
|
|
51ff6d1010
|
cleaning up
|
2019-09-05 13:13:08 +02:00 |
|
|
0b8002f304
|
minor corrections from T2
|
2019-09-05 10:37:42 +02:00 |
|
|
981cccf85f
|
First commit
|
2019-06-16 22:35:10 +02:00 |
|