Input 03-xc.gga_x_pw86.inp
Matches
Name |
Value |
Reference |
Precision |
Difference |
Status |
gga_x_pw86 Eigenvalue up |
-9.580390000000000e-01 |
-9.731150000000000e-01 |
4.400000000000000e-05 |
1.507599999999998e-02 |
FAIL |
gga_x_pw86 Eigenvalue dn |
-4.864720000000000e-01 |
-8.214764999999999e-01 |
4.230000000000000e-05 |
3.350044999999999e-01 |
FAIL |
gga_x_pw86 Exchange |
0.000000000000000e+00 |
-3.223429850000000e-01 |
4.130000000000000e-06 |
3.223429850000000e-01 |
FAIL |
gga_x_pw86 Int[n*v_xc] |
0.000000000000000e+00 |
-4.089226650000000e-01 |
5.100000000000000e-06 |
4.089226650000000e-01 |
FAIL |