Input 04-octopus_basics-visualization.01-benzene.inp
Matches
Name | Value | Reference | Precision | Difference | Status |
SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 5.000000000000000e-02 | 0.000000000000000e+00 | PASS |
Total Energy | -9.936608830700000e+02 | -9.936904111000000e+02 | 3.250000000000000e-02 | 2.952803000005133e-02 | PASS |