Match Total energy
Commits >
Commit 917d830e9234ff154f8a96d6b6c157a89a03a450 >
Run foss_mpi_debug_autotools: [foss2023a-mpi] >
Input 11-isotopes.01-deuterium.inp
Value | Reference | Precision | Status |
-4.575393600000000e-01 | -4.575421500000000e-01 | 3.000000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)