Match Hartree energy
Commits >
Commit b15abc005d0b5301cd748c91bbd98ee634ebaa25 >
Run spack_foss-2022a_cuda_serial >
Input 15-fullerene_stdlcao.01-gs.inp
Value | Reference | Precision | Status |
4.008939339470000e+03 | 4.008939339470000e+03 | 2.000000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)