Match Hartree energy
Commits >
Commit c335ce26b11dabfe3619506d15cfc1285f92daaf >
Run foss-mpi-min: [foss2022a-mpi] >
Input 28-mgga_kli.01-Si_scan.inp
Value | Reference | Precision | Status |
5.621437400000000e-01 | 5.621437400000000e-01 | 2.810000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)