Match Hartree energy
Commits >
Commit 0043f87fd1086e2efddabd576c31b5184d964264 >
Run spack_foss-2022a_cuda_serial >
Input 12-boron_nitride.01-gs.inp
Value | Reference | Precision | Status |
-5.242796955100000e+02 | -5.242796937400001e+02 | 7.300000000000000e-07 | FAIL |
Command: GREPFIELD(static/info, 'Hartree =', 3)