Input 03-xc.gga_xc_edf1.inp
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run foss_cmake: [foss2022a-mpi, foss-full-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
gga_xc_edf1 Eigenvalue up | -9.889420000000000e-01 | -9.889015000000000e-01 | 4.450000000000000e-05 | -4.049999999999887e-05 | PASS |
gga_xc_edf1 Eigenvalue dn | -8.629570000000000e-01 | -8.629195000000001e-01 | 4.120000000000000e-05 | -3.749999999991260e-05 | PASS |
gga_xc_edf1 Correlation | -3.415219200000000e-01 | -3.415181650000000e-01 | 4.130000000000000e-06 | -3.754999999994180e-06 | PASS |
gga_xc_edf1 Int[n*v_xc] | -4.298450400000000e-01 | -4.298403450000000e-01 | 5.160000000000000e-06 | -4.694999999999006e-06 | PASS |