Match RDMFT converged energy
Commits >
Commit dbbd967b788cdda4a2df74a46ac2e5066a09d99b >
Run foss-mpi-debug: [foss2023a-mpi] >
Input 06-rdmft.02-gs_basis.inp
Value | Reference | Precision | Status |
-1.150819646300000e+00 | -1.150582391700000e+00 | 1.000000000000000e-03 | PASS |
Command: GREPFIELD(static/info, 'Total Energy ', 4)