Match Initial energy
Commits >
Commit 2cbd57b62c972cb2ebea8f328fb20b62d521e0ac >
Run spack_foss-2023a_mpi_opt >
Input 21-scissor.01-gs.inp
Value | Reference | Precision | Status |
-4.174917300000000e-01 | -4.174745000000000e-01 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)