Input 01-xc_1d.lda_csc.inp
Commits >
Commit 968a3ff7080ffa1f89f08d37efc7416527769dec >
Run foss_mpi_debug_autotools: [foss2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| LDA CSC Eigenvalue 1 up | -7.971009999999999e-01 | -7.971009999999999e-01 | 3.990000000000000e-07 | 0.000000000000000e+00 | PASS |
| LDA CSC Eigenvalue 2 up | -1.672760000000000e-01 | -1.672760000000000e-01 | 8.360000000000000e-06 | 0.000000000000000e+00 | PASS |
| LDA CSC Eigenvalue 1 dn | -7.751640000000000e-01 | -7.751640000000000e-01 | 3.880000000000000e-05 | 0.000000000000000e+00 | PASS |
| LDA CSC Eigenvalue 2 dn | -8.743300000000000e-02 | -8.743300000000001e-02 | 4.370000000000000e-07 | 1.387778780781446e-17 | PASS |
| LDA Exchange | -1.002416260000000e+00 | -1.002416260000000e+00 | 5.010000000000000e-08 | 0.000000000000000e+00 | PASS |
| LDA CSC Correlation | -4.057819000000000e-02 | -4.057819000000000e-02 | 2.030000000000000e-07 | 0.000000000000000e+00 | PASS |
| LDA CSC Int[n*v_xc] | -1.309698340000000e+00 | -1.309698340000000e+00 | 6.550000000000000e-08 | 2.220446049250313e-16 | PASS |