Match Hartree energy
Commits >
Commit 467aee6bb6aa6bf5b31aed5cccd88bd7f10f5124 >
Run eb_fosscuda-2022a_mpi_omp >
Input 01-nio.01-U5-gs.inp
Value | Reference | Precision | Status |
4.641776931000000e+01 | 4.641776690000000e+01 | 7.890000000000001e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)