Input 03-xc.lda_c_ob_pw.inp
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run foss_cmake: [foss2023a-mpi, foss-full-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
lda_c_ob_pw Eigenvalue up | -5.643070000000000e-01 | -5.642700000000000e-01 | 4.070000000000000e-05 | -3.699999999995374e-05 | PASS |
lda_c_ob_pw Eigenvalue dn | -6.261350000000000e-01 | -6.261080000000000e-01 | 2.970000000000000e-05 | -2.699999999999925e-05 | PASS |
lda_c_ob_pw Correlation | -3.723156000000000e-02 | -3.723119499999999e-02 | 4.010000000000000e-07 | -3.650000000021691e-07 | PASS |
lda_c_ob_pw Int[n*v_xc] | -4.277333000000000e-02 | -4.277292500000000e-02 | 4.450000000000000e-07 | -4.049999999949927e-07 | PASS |