Input 03-xc.lda_c_ob_pw.inp
Commits >
Commit 045d20dc05e1b42e239243cb04e8ce4d1aad770d >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
lda_c_ob_pw Eigenvalue up | -6.405050000000000e-01 | -5.642700000000000e-01 | 4.070000000000000e-05 | -7.623499999999994e-02 | FAIL |
lda_c_ob_pw Eigenvalue dn | -6.087540000000000e-01 | -6.261080000000000e-01 | 2.970000000000000e-05 | 1.735399999999998e-02 | FAIL |
lda_c_ob_pw Correlation | 0.000000000000000e+00 | -3.723119499999999e-02 | 4.010000000000000e-07 | 3.723119499999999e-02 | FAIL |
lda_c_ob_pw Int[n*v_xc] | 0.000000000000000e+00 | -4.277292500000000e-02 | 4.450000000000000e-07 | 4.277292500000000e-02 | FAIL |