|
|
655a30d78f
|
Add "The Quest for Highly Accurate Excitation Energies: A Computational Perspective review" to other publications
|
2020-03-18 15:34:59 +01:00 |
|
|
|
ac60bbb978
|
Merge branch 'publis.yaml' into TBE
|
2020-03-18 14:54:37 +01:00 |
|
|
|
b6d180c933
|
Delete old file format
|
2020-03-18 14:27:47 +01:00 |
|
|
|
cc9e167726
|
Fix formaldehyde STEOM bad method
|
2020-03-17 19:00:44 +01:00 |
|
|
|
622a7dae6a
|
Fix T1 and oscilatorForces inversion
|
2020-03-17 14:00:31 +01:00 |
|
|
|
97f25af23d
|
Add unsafe assertion
|
2020-03-17 13:48:42 +01:00 |
|
|
|
66e47a46ee
|
Fix FC
|
2020-03-15 17:49:22 +01:00 |
|
|
|
df21468622
|
Add assertions
|
2020-03-14 17:29:47 +01:00 |
|
|
|
91781b1c1d
|
Fix number for nitrosomethane CC3 6-31+G(d)
|
2020-03-11 10:52:16 +01:00 |
|
|
|
14446864b5
|
Fix unsafe
|
2020-03-11 10:34:19 +01:00 |
|
|
|
fc44b1e391
|
Fix QUEST#1
|
2020-03-10 19:34:50 +01:00 |
|
|
|
fcf71efa1e
|
Regenerate QUEST#1
|
2020-03-10 18:31:13 +01:00 |
|
|
|
828fa5cf6c
|
Add description class and simplify lables
|
2020-03-08 16:17:04 +01:00 |
|
|
|
e10ade912a
|
fix file name for streptocyanine-C1
|
2020-02-28 16:04:44 +01:00 |
|
|
|
0d2cf406e1
|
Fix doublon
|
2020-02-27 15:14:42 +01:00 |
|
|
|
2f3fd46f46
|
Fix carbon monxide data
|
2020-02-27 13:11:58 +01:00 |
|
|
|
e5c5f120e0
|
Fix doublon
|
2020-02-27 12:43:18 +01:00 |
|
|
|
85d48a336e
|
Fix infinity doublon
|
2020-02-27 12:11:00 +01:00 |
|
|
|
559c8d5eb7
|
Fix bug in nitrosomethane
|
2020-02-27 10:28:08 +01:00 |
|
|
|
a986d9ae72
|
Fix some files
|
2020-02-27 10:23:37 +01:00 |
|
|
|
ad2238c664
|
Fix streptocyanine-C1
|
2020-02-26 16:23:59 +01:00 |
|
|
|
e66c042d2a
|
Optional separator between method and basis in toString() method
|
2020-02-20 11:54:50 +01:00 |
|
|
|
50c814b612
|
Fix formaldehyde
|
2020-02-20 11:03:14 +01:00 |
|
|
|
c9bea63f51
|
Replace formaldehyde
|
2020-02-19 17:14:27 +01:00 |
|
|
|
5fd4ad54c5
|
Use LaTeX standard for \prime
|
2020-02-17 13:25:15 +01:00 |
|
|
|
1c680f819c
|
Fix state number
|
2020-02-17 12:42:25 +01:00 |
|
|
|
1a398bbb50
|
Delete file on bad branch
|
2020-02-17 10:51:58 +01:00 |
|
|
|
0aa6f80735
|
Add missing informations
|
2020-02-17 10:12:42 +01:00 |
|
|
|
6d5c17b92b
|
Add water TBE/CBS
|
2020-02-17 10:09:55 +01:00 |
|
|
|
fe6cf76a69
|
Add streptocyanine-c1
|
2020-02-17 09:53:48 +01:00 |
|
|
|
92673ad0e0
|
Add emoji css class
|
2020-02-16 18:09:37 +01:00 |
|
|
|
d25239ba95
|
Add missing data due to subtablesindex bug
|
2020-02-16 17:57:44 +01:00 |
|
|
|
daa62495fa
|
Add geometry and DOI
|
2020-02-15 17:43:30 +01:00 |
|
|
|
cbb0a8e219
|
Add missing files of QUEST#1
|
2020-02-15 17:40:52 +01:00 |
|
|
|
42a9a35675
|
trigger("change") only at the end and if realy change to optimize performances
|
2020-02-15 11:24:24 +01:00 |
|
|
|
5fb1b4252c
|
Use JSYAML and apply changes
|
2020-02-15 11:19:36 +01:00 |
|
|
|
e7506344c4
|
Add yaml
|
2020-02-14 16:30:30 +01:00 |
|
|
|
e75a1de542
|
Delete usage of zpe folder
|
2020-02-10 16:29:19 +01:00 |
|
|
|
519b237d8d
|
Fix experimental typo
|
2020-02-10 12:01:31 +01:00 |
|
|
|
9ee1565bde
|
Put creation of publication UI in createPubliUI
|
2020-02-08 14:48:40 +01:00 |
|
|
|
ac0c970962
|
Fix publications page
|
2020-02-07 10:16:39 +01:00 |
|
|
|
bb475a0ec3
|
Add reference for QUEST#3
|
2020-02-04 12:11:08 +01:00 |
|
|
|
8f61c51138
|
Delete value propeery of stringNumber
|
2020-02-04 09:34:27 +01:00 |
|
|
|
3c2da95c84
|
rename Float to Number in JavaScript
|
2020-02-04 09:14:57 +01:00 |
|
|
|
5392b9ee53
|
Fix filenames in fluo
|
2020-02-03 17:47:19 +01:00 |
|
|
|
5e5d98fb8d
|
Fix filenames for STEOM-CCSD
|
2020-02-03 17:44:40 +01:00 |
|
|
|
c878b587f2
|
Fix filenames for CCSDR(3)
|
2020-02-03 17:43:00 +01:00 |
|
|
|
0e82af227e
|
Fix CBS filenames
|
2020-02-03 17:41:37 +01:00 |
|
|
|
e759d88c77
|
Fix CBS
|
2020-02-03 15:51:17 +01:00 |
|
|
|
f86ca7a42a
|
Fix methods names
|
2020-02-03 15:07:32 +01:00 |
|
