Match Hartree energy
Commits >
Commit f4bc596bdcf3afff33b833944576bfd5457df1bc >
Run intel-serial: [intel2023a-serial] >
Input 03-ACBN0_restricted.01-lif.inp
Value | Reference | Precision | Status |
8.278887590000000e+00 | 8.278887590000000e+00 | 4.140000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)