srDFT_G2/Data/data_srDFT/data_VDZ/data_SiH3_cc-pVDZ
2018-12-19 11:48:30 +01:00

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# thresh_dens thresh_WF LDA_PSI PBE_PSI
0.000001 0.0000001 -0.2819588054 -0.3113744610
0.000001 0.000001 -0.2819970568 -0.3114903021
0.000001 0.00001 -0.2820773095 -0.3117692096
0.000001 0.0001 -0.2823318882 -0.3127848877
0.000001 0.001 -0.2835145762 -0.3178749355