Match SCF convergence
Commits >
Commit bae4500c7a0d1ba65b012093daf21b2d064fac81 >
Run spack_foss-2022a_cuda_mpi_omp >
Input 13-full_potential_hydrogen.01-gs.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')