Input 03-xc.gga_x_pbea.inp
Commits >
Commit eff5280d65f29f89ecacf7a6e9c2d06020a47460 >
Run intel_mpi_omp_autotools: [intel2022a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| gga_x_pbea Eigenvalue up | -9.648260000000000e-01 | -9.647865000000000e-01 | 4.340000000000000e-05 | -3.949999999997011e-05 | PASS |
| gga_x_pbea Eigenvalue dn | -8.113300000000000e-01 | -8.112925000000000e-01 | 4.130000000000000e-05 | -3.750000000002363e-05 | PASS |
| gga_x_pbea Exchange | -3.120151100000000e-01 | -3.120116200000000e-01 | 3.840000000000000e-06 | -3.489999999994886e-06 | PASS |
| gga_x_pbea Int[n*v_xc] | -4.002273100000000e-01 | -4.002229500000000e-01 | 4.800000000000000e-06 | -4.360000000036557e-06 | PASS |