Input 03-xc.gga_x_lg93.inp
Commits >
Commit 0fe8dcc2cda723db7bfa614b73e6eb662c8bbe1e >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| gga_x_lg93 Eigenvalue up | -9.713380000000000e-01 | -9.713780000000001e-01 | 4.400000000000000e-05 | 4.000000000004000e-05 | PASS |
| gga_x_lg93 Eigenvalue dn | -8.203190000000000e-01 | -8.203575000000001e-01 | 4.230000000000000e-05 | 3.850000000005238e-05 | PASS |
| gga_x_lg93 Exchange | -3.208373200000000e-01 | -3.208410700000000e-01 | 4.140000000000000e-06 | 3.750000000024567e-06 | PASS |
| gga_x_lg93 Int[n*v_xc] | -4.073044700000000e-01 | -4.073090900000000e-01 | 5.080000000000000e-06 | 4.620000000010727e-06 | PASS |