Match Hartree energy
Commits >
Commit a707423db2dcfe1920cae26cacaed48d94544399 >
Run spack_foss-2022a_serial_debug >
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)