Match Hartree energy
Commits >
Commit 70b0ad3565a7ed52254e6fb5a8a40b027abeb4a7 >
Run foss_mpi_autotools: [foss2022a-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)