Input 03-xc.lda_x.inp
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run foss_omp_autotools: [foss2023a-serial]
Matches
Name | Value | Reference | Precision | Difference | Status |
lda_x Eigenvalue up | -9.280400000000000e-01 | -9.280005000000000e-01 | 4.340000000000000e-05 | -3.949999999997011e-05 | PASS |
lda_x Eigenvalue dn | -7.728510000000000e-01 | -7.728159999999999e-01 | 3.850000000000000e-05 | -3.500000000000725e-05 | PASS |
lda_x Exchange | -2.723268400000000e-01 | -2.723241250000000e-01 | 3.000000000000000e-06 | -2.714999999986478e-06 | PASS |
lda_x Int[n*v_xc] | -3.631024500000000e-01 | -3.630988300000000e-01 | 4.000000000000000e-06 | -3.620000000037482e-06 | PASS |