Match Total energy
Commits >
Commit b6caf805fea115365f1246dd8a44b3bc3b7dd03a >
Run spack_foss-2022a_cuda_mpi_omp >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
-3.245061313200000e+02 | -3.245061313400000e+02 | 3.740000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)