Match Total energy
Commits >
Commit 42d5c2c12b8376ac01df1778205b77ce6ca96480 >
Run spack_foss-2023a_mpi >
Input 06-h2o_pol_lr.01_gs.inp
Value | Reference | Precision | Status |
-1.720893825000000e+01 | -1.720893825000000e+01 | 8.600000000000000e-08 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)