Match Hartree energy
Commits >
Commit 7674d3f014e9528d45a88358f14173f28daae041 >
Run foss-mpi-full: [foss2023a-mpi] >
Input 10-vdw_d3_dna.02-gs_d3.inp
Value | Reference | Precision | Status |
3.356150015000000e+02 | 3.356149938300000e+02 | 8.410000000000001e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)