Match Hartree energy
Commits >
Commit 3f59639a2c09960e9ce8b923e2789a20396f5ecf >
Run spack_foss-2022a_cuda_mpi_omp >
Input 12-boron_nitride.01-gs.inp
Value | Reference | Precision | Status |
-5.236158378700000e+02 | -5.236158373600000e+02 | 8.630000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)