Match Hartree energy
Commits >
Commit 04b2a32c6063188a192f0d4e38b2e2adad504be9 >
Run intel-2022b >
Input 11-full_delta.01-gs.inp
Value | Reference | Precision | Status |
2.126656180000000e+00 | 2.126656180000000e+00 | 1.060000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)