Input 03-xc.gga_x_ft97_b.inp
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run foss_ppc_autotools: [foss2022a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| gga_x_ft97_b Eigenvalue up | -9.721300000000000e-01 | -9.720900000000000e-01 | 4.400000000000000e-05 | -4.000000000004000e-05 | PASS |
| gga_x_ft97_b Eigenvalue dn | -8.265850000000000e-01 | -8.265470000000000e-01 | 4.180000000000000e-05 | -3.799999999998249e-05 | PASS |
| gga_x_ft97_b Exchange | -3.288272100000000e-01 | -3.288234400000000e-01 | 4.170000000000000e-06 | -3.769999999958529e-06 | PASS |
| gga_x_ft97_b Int[n*v_xc] | -4.091211800000000e-01 | -4.091167250000000e-01 | 4.920000000000000e-06 | -4.454999999958797e-06 | PASS |