loos/srDFT_G2
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Data and manuscript for Loos et al. J. Phys. Chem. Lett. 10, 2931 (2019).
159 Commits 1 Branch 0 Tags 80 MiB
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eginer c293cb38e7 added Big_data/Mixed_core vdz and vtz with proper names and sorting
2019-04-02 11:36:49 +02:00
Big_data added Big_data/Mixed_core vdz and vtz with proper names and sorting 2019-04-02 11:36:49 +02:00
Data g09 input 2019-03-25 22:30:19 +01:00
Data_DFT added data vqz 2019-03-31 17:01:41 +02:00
G09 updated G09 data 2019-04-02 11:16:28 +02:00
Manuscript finished table for manuscript 2019-04-02 11:07:57 +02:00
Ref updated atomization energies 2019-03-31 19:10:04 +02:00
References refs 2019-03-22 17:21:29 +01:00
README.md Initial commit 2018-12-04 15:13:53 +01:00
srDFT_G2.nb refs 2019-03-22 15:34:15 +01:00

README.md

srDFT_G2