Input 03-xc.lda_c_ob_pz.inp
Commits >
Commit 968a3ff7080ffa1f89f08d37efc7416527769dec >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
lda_c_ob_pz Eigenvalue up | -5.616420000000000e-01 | -5.616795000000000e-01 | 4.130000000000000e-05 | 3.750000000002363e-05 | PASS |
lda_c_ob_pz Eigenvalue dn | -6.292960000000000e-01 | -6.293230000000000e-01 | 2.970000000000000e-05 | 2.699999999999925e-05 | PASS |
lda_c_ob_pz Correlation | -3.653089000000000e-02 | -3.653124000000001e-02 | 3.850000000000000e-07 | 3.500000000031256e-07 | PASS |
lda_c_ob_pz Int[n*v_xc] | -4.134288000000000e-02 | -4.134324000000000e-02 | 3.960000000000000e-07 | 3.600000000048009e-07 | PASS |