Input 03-xc.gga_c_pbe_sol.inp
Commits >
Commit 9c5e1a9ae4a97d24a493b8c6c0caa96edfef5d41 >
Run foss_cuda_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| gga_c_pbe_sol Eigenvalue up | -5.489270000000001e-01 | -5.489645000000001e-01 | 4.120000000000000e-05 | 3.750000000002363e-05 | PASS |
| gga_c_pbe_sol Eigenvalue dn | -5.958090000000000e-01 | -5.958350000000000e-01 | 2.860000000000000e-05 | 2.599999999997049e-05 | PASS |
| gga_c_pbe_sol Correlation | -1.754522000000000e-02 | -1.754537500000000e-02 | 1.700000000000000e-07 | 1.550000000016816e-07 | PASS |
| gga_c_pbe_sol Int[n*v_xc] | -2.447324000000000e-02 | -2.447345500000000e-02 | 2.360000000000000e-07 | 2.149999999978558e-07 | PASS |