Input 17-absorption-spin_symmetry.01-gs.inp
Commits >
Commit 235dfa244e23366de619648bda83df5634b8df23 >
Run intel_autotools: [intel2023a-serial]
Matches
Name | Value | Reference | Precision | Difference | Status |
SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
Initial energy | -1.129907420000000e+01 | -1.129907420000000e+01 | 5.650000000000000e-07 | 0.000000000000000e+00 | PASS |