Match Hartree energy
Commits >
Commit efc44ae2259e56922145db535c825ce53e4127cb >
Run intel_omp_autotools: [intel2023a-serial] >
Input 10-vdw_d3_dna.02-gs_d3.inp
Value | Reference | Precision | Status |
3.356150007300000e+02 | 3.356149938300000e+02 | 8.410000000000001e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)