Match RDMFT converged energy
Commits >
Commit c2137da3c7eed40c7b1d2dc83d2ec8c4c87fbf0f >
Run foss_mpi_min_autotools: [foss2022a-mpi] >
Input 06-rdmft.02-gs_basis.inp
Value | Reference | Precision | Status |
-1.150819633700000e+00 | -1.150582391700000e+00 | 1.000000000000000e-03 | PASS |
Command: GREPFIELD(static/info, 'Total Energy ', 4)