Input 03-xc.gga_x_pbea.inp
Commits >
Commit 045d20dc05e1b42e239243cb04e8ce4d1aad770d >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| gga_x_pbea Eigenvalue up | -9.521720000000000e-01 | -9.647865000000000e-01 | 4.340000000000000e-05 | 1.261449999999997e-02 | FAIL |
| gga_x_pbea Eigenvalue dn | -4.864720000000000e-01 | -8.112925000000000e-01 | 4.130000000000000e-05 | 3.248205000000000e-01 | FAIL |
| gga_x_pbea Exchange | 0.000000000000000e+00 | -3.120116200000000e-01 | 3.840000000000000e-06 | 3.120116200000000e-01 | FAIL |
| gga_x_pbea Int[n*v_xc] | 0.000000000000000e+00 | -4.002229500000000e-01 | 4.800000000000000e-06 | 4.002229500000000e-01 | FAIL |