Input 03-xc.gga_x_wc.inp
Commits >
Commit eff5280d65f29f89ecacf7a6e9c2d06020a47460 >
Run intel_mpi_autotools: [intel2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| gga_x_wc Eigenvalue up | -9.615200000000000e-01 | -9.614805000000000e-01 | 4.350000000000000e-05 | -3.950000000008114e-05 | PASS |
| gga_x_wc Eigenvalue dn | -8.084620000000000e-01 | -8.084249999999999e-01 | 4.070000000000000e-05 | -3.700000000006476e-05 | PASS |
| gga_x_wc Exchange | -3.096181900000000e-01 | -3.096147750000000e-01 | 3.760000000000000e-06 | -3.415000000006607e-06 | PASS |
| gga_x_wc Int[n*v_xc] | -3.970087800000000e-01 | -3.970044950000000e-01 | 4.700000000000000e-06 | -4.284999999992767e-06 | PASS |