Match Hartree energy
Commits >
Commit 3f59639a2c09960e9ce8b923e2789a20396f5ecf >
Run spack_intel-2023a_serial_omp >
Input 14-fullerene_unpacked.01-gs.inp
Value | Reference | Precision | Status |
3.988936436820000e+03 | 3.988936413230000e+03 | 2.750000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)