Input 03-xc.gga_x_pw91.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| gga_x_pw91 Eigenvalue up |
-9.693480000000000e-01 |
-9.693879999999999e-01 |
4.400000000000000e-05 |
3.999999999992898e-05 |
PASS |
| gga_x_pw91 Eigenvalue dn |
-8.165070000000000e-01 |
-8.165445000000000e-01 |
4.130000000000000e-05 |
3.750000000002363e-05 |
PASS |
| gga_x_pw91 Exchange |
-3.171790000000000e-01 |
-3.171825800000000e-01 |
3.940000000000000e-06 |
3.580000000003025e-06 |
PASS |
| gga_x_pw91 Int[n*v_xc] |
-4.049501500000000e-01 |
-4.049545750000000e-01 |
4.880000000000000e-06 |
4.424999999974588e-06 |
PASS |