Match Hartree energy
Commits >
Commit 0043f87fd1086e2efddabd576c31b5184d964264 >
Run spack_foss-2022a_serial >
Input 02-ACBN0.01-nio.inp
Value | Reference | Precision | Status |
8.788829204000000e+01 | 8.788829173000001e+01 | 1.410000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)