Input 03-xc.gga_c_lm.inp
Commits >
Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e >
Run foss_cuda_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| gga_c_lm Eigenvalue up (libxc5) | -5.901500000000000e-01 | -5.902250000000000e-01 | 8.250000000000000e-05 | 7.500000000004725e-05 | PASS |
| gga_c_lm Eigenvalue dn (libxc5) | -6.502820000000000e-01 | -6.503380000000000e-01 | 6.160000000000001e-05 | 5.599999999994498e-05 | PASS |
| gga_c_lm Correlation (libxc5) | -7.244122000000000e-02 | -7.244304000000000e-02 | 2.000000000000000e-06 | 1.819999999999600e-06 | PASS |
| gga_c_lm Int[n*v_xc] (libxc5) | -6.834678000000000e-02 | -6.834823000000000e-02 | 1.600000000000000e-06 | 1.450000000000062e-06 | PASS |