Match RDMFT converged energy
Commits >
Commit 49118372ba86b967cc9f5fccbbf24835f53b10d7 >
Run spack_foss-2022a_cuda_serial >
Input 06-rdmft.02-gs_basis.inp
Value | Reference | Precision | Status |
-1.150739987100000e+00 | -1.150582391700000e+00 | 1.000000000000000e-03 | PASS |
Command: GREPFIELD(static/info, 'Total Energy ', 4)