Match Hartree energy
Commits >
Commit a4341ac9f169107ec4cef5019cc6269df7c401ac >
Run spack_foss-2023b_serial >
Input 14-fullerene_unpacked.01-gs.inp
Value | Reference | Precision | Status |
3.988936388270000e+03 | 3.988936413230000e+03 | 2.750000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)