Match Hartree energy
Commits >
Commit 69bdc22e524ab1df7701119670aff9b913714e90 >
Run foss_cmake: [foss2022a-serial, foss-full] >
Input 10-vdw_d3_dna.02-gs_d3.inp
Value | Reference | Precision | Status |
3.356149875100000e+02 | 3.356149938300000e+02 | 8.410000000000001e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)