Match RDMFT converged energy
Commits >
Commit 37e237ddc5fb12f3241bf77b2f48251725ccbfb8 >
Run spack_foss-2022a_serial_debug >
Input 06-rdmft.02-gs_basis.inp
Value | Reference | Precision | Status |
-1.150819617800000e+00 | -1.150582391700000e+00 | 1.000000000000000e-03 | PASS |
Command: GREPFIELD(static/info, 'Total Energy ', 4)