|
|
3d192d3cde
|
Increase the size of graph +50%
|
2020-09-16 10:01:40 +02:00 |
|
|
|
7f37ee8000
|
Add unit to legend
|
2020-09-16 09:27:06 +02:00 |
|
|
|
4dddd52b07
|
Replace energy by error
|
2020-09-16 09:21:20 +02:00 |
|
|
|
3c3218dcf2
|
Fix x axis label
|
2020-09-15 16:56:39 +02:00 |
|
|
|
220314190b
|
Replace MAD by MAE
|
2020-09-15 15:56:15 +02:00 |
|
|
|
abaee88903
|
Fix code.fromString must retrun a code not a method
|
2020-09-15 15:31:17 +02:00 |
|
|
|
537d627fbf
|
Add ADC(2.5) for QUEST#3 addon
|
2020-09-15 15:27:25 +02:00 |
|
|
|
736221223c
|
Add code for QUEST#3 ADC addon
|
2020-09-15 15:22:02 +02:00 |
|
|
|
69cd916909
|
Merge branch 'master' into ADC
|
2020-09-15 15:21:15 +02:00 |
|
|
|
dfb6a2a14a
|
Add code for QUEST#3 ADC
|
2020-09-15 15:21:02 +02:00 |
|
|
|
e08001afb8
|
Merge branch 'master' into ADC
|
2020-09-15 13:02:07 +02:00 |
|
|
|
c12a798cbc
|
Fix upercase cc in basis
|
2020-09-15 13:01:50 +02:00 |
|
|
|
03577a4636
|
Merge branch 'master' into ADC
|
2020-09-15 12:52:30 +02:00 |
|
|
|
c89e865597
|
Improvement in ADC25generator
|
2020-09-15 12:51:47 +02:00 |
|
|
|
b250227f47
|
Use os.makedirs instead of mkdir
|
2020-09-15 12:51:07 +02:00 |
|
|
|
c6e6f308d0
|
Put geom in QUEST#3 ADC
|
2020-09-15 10:31:34 +02:00 |
|
|
|
45cbad1cc6
|
Merge branch 'master' into ADC
|
2020-09-15 09:53:53 +02:00 |
|
|
|
093dc61602
|
Update README
|
2020-09-15 09:39:23 +02:00 |
|
|
|
5193c5630f
|
Fix QUEST#5 data and update it
|
2020-09-15 09:32:55 +02:00 |
|
|
|
252884d995
|
Fix missing geometry
|
2020-09-14 17:24:34 +02:00 |
|
|
|
7790367ee0
|
DOI not yet replaced by article in ADC files
|
2020-09-14 16:32:11 +02:00 |
|
|
|
b318108be7
|
Merge branch 'master' into ADC
|
2020-09-14 16:15:13 +02:00 |
|
|
|
d0870a2d0f
|
Support scrollIntoView for sets
|
2020-09-14 16:01:29 +02:00 |
|
|
|
f15140bc64
|
Change QUEST link to absolute in subsets
|
2020-09-14 15:16:24 +02:00 |
|
|
|
8e7ae39bee
|
Merge branch 'master' of git.irsamc.ups-tlse.fr:mveril/exdatabaseLCPQ
|
2020-09-14 11:31:04 +02:00 |
|
|
|
93a38ff9ce
|
Add ADC(2.5) files
|
2020-09-14 11:30:57 +02:00 |
|
|
|
34b5a57f9e
|
Add the ADC25generator python tool
|
2020-09-14 11:29:13 +02:00 |
|
|
|
0a8cf70a73
|
subsets
|
2020-09-14 09:57:04 +02:00 |
|
|
|
3fa6aa7496
|
typo
|
2020-09-13 20:40:57 +02:00 |
|
|
|
a9bba27fcb
|
Merge branch 'master' of git.irsamc.ups-tlse.fr:mveril/exdatabaseLCPQ
|
2020-09-13 18:23:37 +02:00 |
|
|
|
8dcab0b702
|
Fix number for Nitrosomethane ADC(2)/aug-cc-pVTZ
|
2020-09-13 18:16:15 +02:00 |
|
|
|
9ca621dd99
|
logos
|
2020-09-12 22:27:15 +02:00 |
|
|
|
853b045431
|
logo
|
2020-09-12 16:44:58 +02:00 |
|
|
|
0cbee99f78
|
Add the ability to read a data file from the python library
|
2020-09-11 17:26:49 +02:00 |
|
|
|
3f9f7108b3
|
hasType test is now irrelevent
|
2020-09-11 16:55:53 +02:00 |
|
|
|
1ac008613c
|
subsets
|
2020-09-11 14:33:45 +02:00 |
|
|
|
707606956d
|
square logo
|
2020-09-11 14:29:42 +02:00 |
|
|
|
a97dd01841
|
justidy
|
2020-09-11 14:15:15 +02:00 |
|
|
|
7ad27a0a26
|
justify index
|
2020-09-11 14:09:44 +02:00 |
|
|
|
283f231309
|
Merge branch 'master' of https://git.irsamc.ups-tlse.fr/mveril/exdatabaseLCPQ
|
2020-09-11 13:57:44 +02:00 |
|
|
|
43431ed077
|
OK with front page
|
2020-09-11 13:57:40 +02:00 |
|
|
|
996f89518d
|
Fix typo and add inline code to README
|
2020-09-11 12:47:11 +02:00 |
|
|
|
892ea5f071
|
Fix repo relative url
|
2020-09-11 12:03:34 +02:00 |
|
|
|
bc3a86bde6
|
Add README.md
|
2020-09-11 11:58:33 +02:00 |
|
|
|
169f385c42
|
Remove unused variable
|
2020-09-11 10:57:05 +02:00 |
|
|
|
363547714e
|
Fix CNRS.png is not an executable
|
2020-09-11 10:18:16 +02:00 |
|
|
|
8a85918f96
|
Merge branch 'master' into ADC
|
2020-09-11 09:33:24 +02:00 |
|
|
|
6363b8d79f
|
Merge branch 'master' of git.irsamc.ups-tlse.fr:mveril/exdatabaseLCPQ
|
2020-09-11 09:32:18 +02:00 |
|
|
|
942fba5f7f
|
Performance improvement; don't use the data files for the generation but only the YAML of the publications page
|
2020-09-11 09:32:13 +02:00 |
|
|
|
2557500544
|
minor corrections
|
2020-09-10 21:38:14 +02:00 |
|
