Match SCF convergence
Commits >
Commit 3f59639a2c09960e9ce8b923e2789a20396f5ecf >
Run spack_foss-2023a_mpi_opt >
Input 21-qedft-breit-3d.02-pxlda-helium.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 2.300000000000000e-07 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')