Input 03-xc.gga_x_pbe_r.inp
Commits >
Commit b7dcc99023940be2b83de00317ffa33e598f3f55 >
Run foss_cmake: [foss2022a-serial, foss-min]
Matches
Name | Value | Reference | Precision | Difference | Status |
gga_x_pbe_r Eigenvalue up | -9.720850000000000e-01 | -9.720450000000000e-01 | 4.400000000000000e-05 | -3.999999999992898e-05 | PASS |
gga_x_pbe_r Eigenvalue dn | -8.229290000000000e-01 | -8.228910000000000e-01 | 4.180000000000000e-05 | -3.799999999998249e-05 | PASS |
gga_x_pbe_r Exchange | -3.239907400000000e-01 | -3.239870300000000e-01 | 4.090000000000000e-06 | -3.709999999990110e-06 | PASS |
gga_x_pbe_r Int[n*v_xc] | -4.083539800000000e-01 | -4.083495100000000e-01 | 4.940000000000000e-06 | -4.470000000034169e-06 | PASS |