Input 03-xc.gga_x_lg93.inp
Commits >
Commit 6dda27ed08cd9fd2b2f861e6109ead2bd6d3cd56 >
Run intel_omp_autotools: [intel2023a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| gga_x_lg93 Eigenvalue up | -9.714180000000000e-01 | -9.713780000000001e-01 | 4.400000000000000e-05 | -3.999999999992898e-05 | PASS |
| gga_x_lg93 Eigenvalue dn | -8.203960000000000e-01 | -8.203575000000001e-01 | 4.230000000000000e-05 | -3.849999999994136e-05 | PASS |
| gga_x_lg93 Exchange | -3.208448100000000e-01 | -3.208410700000000e-01 | 4.140000000000000e-06 | -3.739999999974319e-06 | PASS |
| gga_x_lg93 Int[n*v_xc] | -4.073136900000000e-01 | -4.073090900000000e-01 | 5.080000000000000e-06 | -4.600000000021254e-06 | PASS |