Match Hartree energy
Commits >
Commit 49118372ba86b967cc9f5fccbbf24835f53b10d7 >
Run spack_foss-2023a_valgrind >
Input 12-boron_nitride.01-gs.inp
Value | Reference | Precision | Status |
-5.236158366900000e+02 | -5.236158373600000e+02 | 8.630000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)