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Commit Graph

79 Commits

Author SHA1 Message Date
68eac5baf5 Add Larger compounds table of supporting 2020-01-29 17:20:34 +01:00
0da83827b0 Add thioformaldehyde CC3 supporting 2020-01-29 17:20:34 +01:00
46a96c3329 Add Methanimine CC3 supporting 2020-01-29 17:20:34 +01:00
81ad786acd Add Formaldehyde CC3 supporting 2020-01-29 17:20:34 +01:00
ea27a61da6 Add Ethylene CC3 supporting 2020-01-29 17:20:34 +01:00
cc6f12852e Add acetylene CC3 supporting 2020-01-29 17:20:34 +01:00
9b9fa79d88 Add Carbon monoxide CC3 supporting 2020-01-29 17:20:34 +01:00
1e6248812c Fix Full FC in basis 2020-01-29 17:20:34 +01:00
7349f30380 Add Dinitrogen CC3 supporting 2020-01-29 17:20:34 +01:00
42f2712f67 Add hydrogen chloride CC3 supporting 2020-01-29 17:20:34 +01:00
8034c12340 Add ammonia CC3 supporting 2020-01-29 17:20:34 +01:00
ba3cc8382b Add hydrogen sulfide CC3 supporting 2020-01-29 17:20:34 +01:00
a8b14bba72 Add water CC3 supporting 2020-01-29 17:20:34 +01:00
705bc731bc Rename and fix TBE and TBE(FC) 2020-01-29 17:20:34 +01:00
7d2f503388 Add basis for TBE 2020-01-29 17:20:34 +01:00
3a72177129 Add code 2020-01-29 17:20:34 +01:00
8caf38678a Add geometry 2020-01-29 17:20:34 +01:00
fc6b536cab Replace method with expermental when is needed 2020-01-29 17:20:34 +01:00
e3fc183184 Add DOI 2020-01-29 17:20:34 +01:00
3c54772499 Rename exp 2020-01-29 17:20:34 +01:00
288a0a8650 Delete all Th and Theo 2020-01-29 17:20:34 +01:00
a650004aa9 Add TBE 2020-01-29 17:20:34 +01:00
575cb8d08c Add first vertical table 2020-01-29 17:20:34 +01:00
ae5b602ed6 Add thioformaldehyde 2020-01-29 17:20:34 +01:00
8be807fbd5 Add methanimine 2020-01-29 17:20:34 +01:00
ed13c31f36 Add formaldehyde 2020-01-29 17:20:34 +01:00
289853ddfb Add ethylene 2020-01-29 17:20:34 +01:00
e5a47f7ed7 Add acetylene 2020-01-29 17:20:34 +01:00
c30cb69997 Add carbon monoxide 2020-01-29 17:20:34 +01:00
8cb4cf8feb Add dinitrogen 2020-01-29 17:20:34 +01:00
6b227943ea Delete not wanted file and rename exp 2020-01-29 17:20:34 +01:00
02d948ea75 Add ammonia 2020-01-29 17:20:34 +01:00
0cef9b8935 Add Hydrogen sulfide 2020-01-29 17:20:34 +01:00
51651c4887 Rename exp and delete unnescesary files 2020-01-29 17:20:34 +01:00
2030daf9e9 Add first table 2020-01-29 17:20:34 +01:00
5b977b8d52 Delete all data 2020-01-29 17:20:34 +01:00
5d3719332a Move files on the right place 2020-01-29 17:20:34 +01:00
76c04462f7 Fix space in file 2020-01-29 17:20:34 +01:00
645e7c890a Fix some bugs and change { bracket to ( to fix a bug 2020-01-29 17:20:34 +01:00
b536174991 Add files for TBE 2020-01-29 17:20:34 +01:00
c47cc2ee28 Revert "Add TBE files"
This reverts commit bd88d17d776833c3fc4c764b12c460f92d0e18c6.
2020-01-29 17:20:34 +01:00
24bcc5bc7f Add TBE files 2020-01-29 17:20:34 +01:00
bb2e955da9 Add datasets 2019-11-27 18:29:29 +01:00
41386795e1 Fix point 2019-11-21 10:09:29 +01:00
c16a1f5fc9 Add data from the first second type tabular 2019-11-19 14:19:45 +01:00
83a29add4c Add thioformaldehyde data 2019-11-18 11:47:07 +01:00
b8a22cd504 Add methanimine data 2019-11-18 10:42:51 +01:00
86ba8c5872 Delete inexisting fluorescence and zpe for water 2019-11-18 10:17:55 +01:00
332d73a3c0 Delete not used data files 2019-11-17 17:46:19 +01:00
021411bb40 Fix # Number Spin Symm comment 2019-11-17 17:43:01 +01:00