Commit Graph

9 Commits

Author SHA1 Message Date
f1d05e6ac3 H2 BLYP results 2021-01-20 15:54:32 +01:00
c1f56bede3 H2 TD-BLYP results 2021-01-20 14:53:30 +01:00
ecb8acd30d H2 b3lyp results 2021-01-20 08:12:46 +01:00
e534bb8b0e H2 TDDFT Gaussian results 2021-01-19 16:33:50 +01:00
a9c5953927 remove tddft qchem results 2021-01-19 14:37:10 +01:00
00cf2ba88b Notebook + Manuscript 2021-01-12 10:02:57 +01:00
7e2bca66bb H2 TDDFT output Gaussian 2021-01-11 08:42:30 +01:00
777e4c57c7 output 2021-01-06 16:05:07 +01:00
f1209227e7 rearrangement 2021-01-06 15:47:42 +01:00