Match Hartree energy
Commits >
Commit d89ed1adec8f63937926022ba961c15ddb98b66b >
Run valgrind: [foss2023a-serial] >
Input 10-intersite.01-Na2.inp
Value | Reference | Precision | Status |
4.703058200000000e-01 | 4.703058300000000e-01 | 2.350000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)