Input 03-xc.gga_c_lyp.inp
Commits >
Commit 045d20dc05e1b42e239243cb04e8ce4d1aad770d >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| gga_c_lyp Eigenvalue up | -6.173360000000000e-01 | -5.414225000000000e-01 | 4.130000000000000e-05 | -7.591349999999997e-02 | FAIL |
| gga_c_lyp Eigenvalue dn | -5.497560000000000e-01 | -5.890445000000000e-01 | 2.810000000000000e-05 | 3.928849999999995e-02 | FAIL |
| gga_c_lyp Correlation | 0.000000000000000e+00 | -1.069975500000000e-02 | 7.150000000000000e-08 | 1.069975500000000e-02 | FAIL |
| gga_c_lyp Int[n*v_xc] | 0.000000000000000e+00 | -1.708247500000000e-02 | 3.030000000000000e-07 | 1.708247500000000e-02 | FAIL |