Match Hartree energy
Commits >
Commit 3f3300a09a325083399ad405019c399609c6d1c2 >
Run intel_autotools: [intel2023a-serial] >
Input 10-vdw_d3_dna.02-gs_d3.inp
Value | Reference | Precision | Status |
3.356150014800000e+02 | 3.356149938300000e+02 | 8.410000000000001e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)