Name |
Value |
Reference |
Precision |
Difference |
Status |
gga_xc_b97_d Eigenvalue up |
-9.868370000000000e-01 |
-9.868770000000000e-01 |
4.400000000000000e-05 |
4.000000000004000e-05 |
PASS |
gga_xc_b97_d Eigenvalue dn |
-8.794080000000000e-01 |
-8.794480000000000e-01 |
4.400000000000000e-05 |
4.000000000004000e-05 |
PASS |
gga_xc_b97_d Correlation |
-3.405914000000000e-01 |
-3.405951950000000e-01 |
4.150000000000000e-06 |
3.795000000028637e-06 |
PASS |
gga_xc_b97_d Int[n*v_xc] |
-4.315216900000000e-01 |
-4.315265750000000e-01 |
5.350000000000000e-06 |
4.885000000010020e-06 |
PASS |