Match Hartree energy
Commits >
Commit 467aee6bb6aa6bf5b31aed5cccd88bd7f10f5124 >
Run intel-2022b >
Input 10-vdw_d3_dna.02-gs_d3.inp
Value | Reference | Precision | Status |
3.356159261400000e+02 | 3.356159261400000e+02 | 1.680000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)