srDFT_G2/Data/data_srDFT/data_VTZ/data_H2S_cc-pVTZ_HF_PBE
2018-12-19 11:48:30 +01:00

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# thresh_dens thresh_WF PBE_HF
0.000001 0.0000001 -0.3095275586
0.000001 0.000001 -0.3097189283