Input 03-xc.gga_x_pbea.inp
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| gga_x_pbea Eigenvalue up | -9.647470000000000e-01 | -9.647865000000000e-01 | 4.340000000000000e-05 | 3.949999999997011e-05 | PASS |
| gga_x_pbea Eigenvalue dn | -8.112549999999999e-01 | -8.112925000000000e-01 | 4.130000000000000e-05 | 3.750000000002363e-05 | PASS |
| gga_x_pbea Exchange | -3.120081300000000e-01 | -3.120116200000000e-01 | 3.840000000000000e-06 | 3.489999999994886e-06 | PASS |
| gga_x_pbea Int[n*v_xc] | -4.002185900000000e-01 | -4.002229500000000e-01 | 4.800000000000000e-06 | 4.359999999981046e-06 | PASS |