Match Hartree energy
Commits >
Commit ee11de90c734467b7aebfc32d0117fe9ec1eea84 >
Run spack_foss-2023a_serial_opt >
Input 14-carbon_dojo_psp8.01-gs.inp
Value | Reference | Precision | Status |
1.205197287800000e+02 | 1.205197287800000e+02 | 6.030000000000000e-08 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)