Match Hartree energy
Commits >
Commit 04b2a32c6063188a192f0d4e38b2e2adad504be9 >
Run intel-2022b >
Input 13-primitive.01-diamond.inp
Value | Reference | Precision | Status |
1.000014420000000e+00 | 1.000000000000000e+00 | 5.000000000000000e+00 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)