Input 01-carbon_atom.03-static_field.inp
Commits >
Commit eff5280d65f29f89ecacf7a6e9c2d06020a47460 >
Run foss_cmake: [foss2022a-mpi, foss-full-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
Total energy | -1.468095087500000e+02 | -1.468095090000000e+02 | 7.340000000000000e-06 | 2.499999993688107e-07 | PASS |
Int[n*v_E] | -1.362760000000000e-03 | -1.362760000000000e-03 | 6.809999999999999e-08 | 0.000000000000000e+00 | PASS |