Input 03-xc.gga_xc_hcth_147.inp

Commits > Commit b2c9b4a951ad3e3faeb99c2d543d652f634c0371 > Run spack_foss-2022a_serial_min

Matches

Name Value Reference Precision Difference Status
gga_xc_hcth_147 Eigenvalue up -9.949320000000000e-01 -9.948920000000000e-01 4.400000000000000e-05 -4.000000000004000e-05 PASS
gga_xc_hcth_147 Eigenvalue dn -8.744210000000000e-01 -8.743814999999999e-01 4.350000000000000e-05 -3.950000000008114e-05 PASS
gga_xc_hcth_147 Correlation -3.445582300000000e-01 -3.445545750000000e-01 4.040000000000000e-06 -3.655000000046815e-06 PASS
gga_xc_hcth_147 Int[n*v_xc] -4.369299100000000e-01 -4.369252250000000e-01 5.180000000000000e-06 -4.685000000004269e-06 PASS
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