srDFT_G2/Big_data/Small_core/vdz
2019-03-28 00:30:26 +01:00
..
data_CC_vdz added Big_data/Small_core vdz and vtz 2019-03-28 00:30:26 +01:00
data_CC_vdz_g09 added Big_data/Small_core vdz and vtz 2019-03-28 00:30:26 +01:00
data_CC+LDA_ful_vdz added Big_data/Small_core vdz and vtz 2019-03-28 00:30:26 +01:00
data_CC+LDA_val_vdz added Big_data/Small_core vdz and vtz 2019-03-28 00:30:26 +01:00
data_CC+PBE_ful_vdz added Big_data/Small_core vdz and vtz 2019-03-28 00:30:26 +01:00
data_CC+PBE_val_vdz added Big_data/Small_core vdz and vtz 2019-03-28 00:30:26 +01:00
data_HF_vdz added Big_data/Small_core vdz and vtz 2019-03-28 00:30:26 +01:00
data_HF_vdz_g09 added Big_data/Small_core vdz and vtz 2019-03-28 00:30:26 +01:00
data_LDA_vdz added Big_data/Small_core vdz and vtz 2019-03-28 00:30:26 +01:00
data_PBE_vdz added Big_data/Small_core vdz and vtz 2019-03-28 00:30:26 +01:00
produce_data_DFT.py added Big_data/Small_core vdz and vtz 2019-03-28 00:30:26 +01:00