Input 06-restart.03-gs_mixvhxc.inp
Commits >
Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e >
Run GCI_intel_mpi_omp_autotools: [intel2022a-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 4.270000000000000e-05 | 0.000000000000000e+00 | PASS |
Eigenvalue [up] | -4.001100000000000e-02 | -4.002000000000000e-02 | 2.000000000000000e-04 | 9.000000000002062e-06 | PASS |
Eigenvalue [dn] | -7.291599999999999e-02 | -7.291499999999999e-02 | 3.650000000000000e-05 | -1.000000000001000e-06 | PASS |