Commit Graph

17 Commits

Author SHA1 Message Date
Emmanuel Giner
20c3de0acf good G2 data in VTZ 2019-03-13 11:21:30 +01:00
1affba101e graphs with PBE 2019-03-06 21:32:16 +01:00
eginer
c9be3e2cec added G2_CIPSI_VDZ_PBE.dat G2_CIPSI_VDZ_PBE_valence.dat 2019-03-06 17:18:56 +01:00
eginer
1dabe9bb40 added G2_CIPSI_VTZ_PBE.dat G2_CIPSI_VTZ_PBE_valence.dat 2019-03-05 14:05:33 +01:00
eginer
eeeecd7bff added data_HF_PBE_VDZ data_HF_PBE_VTZ 2019-03-05 14:02:54 +01:00
d473c3aa67 graphs for Manu 2019-03-02 15:34:15 +01:00
eginer
7e7c511c14 added G2 data for LDA HF and valence 2019-03-02 14:51:20 +01:00
Emmanuel Giner
cd405be0ed beginning to script data 2019-03-01 01:54:10 +01:00
db1aeeee0d data plain CIPSI 2019-02-28 14:16:20 +01:00
286a3b4144 nb 2019-02-28 14:08:23 +01:00
Emmanuel Giner
7a413dc9d3 added data_HF_LDA_VDZ 2019-02-28 13:43:25 +01:00
Emmanuel Giner
4b575a7bf0 added final data 2018-12-19 14:26:23 +01:00
Emmanuel Giner
5c0321dfbf data_VTZ/ 2018-12-19 12:49:56 +01:00
Emmanuel Giner
f5bec72ba0 adde data_sr_dft_new/ 2018-12-19 12:47:52 +01:00
Emmanuel Giner
cd437fca20 Na Li 2018-12-19 12:10:16 +01:00
Emmanuel Giner
b43ee92009 added data_VDZ/ data_VTZ/ 2018-12-19 11:48:30 +01:00
Pierre-Francois Loos
813602bcf6 Initial commit 2018-12-04 15:15:01 +01:00