Input 03-xc.gga_xc_hcth_120.inp
Commits >
Commit 045d20dc05e1b42e239243cb04e8ce4d1aad770d >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| gga_xc_hcth_120 Eigenvalue up | -9.697020000000000e-01 | -9.934925000000000e-01 | 4.340000000000000e-05 | 2.379050000000005e-02 | FAIL |
| gga_xc_hcth_120 Eigenvalue dn | -5.462480000000000e-01 | -8.725645000000000e-01 | 4.350000000000000e-05 | 3.263165000000000e-01 | FAIL |
| gga_xc_hcth_120 Correlation | 0.000000000000000e+00 | -3.422285150000000e-01 | 4.040000000000000e-06 | 3.422285150000000e-01 | FAIL |
| gga_xc_hcth_120 Int[n*v_xc] | 0.000000000000000e+00 | -4.354424600000000e-01 | 5.200000000000000e-06 | 4.354424600000000e-01 | FAIL |