Commit Graph

7 Commits

Author SHA1 Message Date
eginer
429b6f404d re-added Large_core 2019-03-28 15:06:14 +01:00
Emmanuel Giner
99487da7ac extracted data for Small core CC/HF G09 2019-03-28 00:27:01 +01:00
Emmanuel Giner
afbbf3f1bc added Small core data CC 2019-03-28 00:25:00 +01:00
Emmanuel Giner
1ceb42d8bf moved the Large_core data in an other folder 2019-03-27 13:39:18 +01:00
5715e3de12 atoms for small cores 2019-03-27 13:22:37 +01:00
Emmanuel Giner
f1e4015e88 produced total energies in vdz and vtz for g09 2019-03-27 11:46:26 +01:00
e3dced28a5 CCSD(T) 2019-03-27 11:25:55 +01:00