Match Total energy
Commits >
Commit b6caf805fea115365f1246dd8a44b3bc3b7dd03a >
Run spack_foss-2022a_cuda_mpi_omp >
Input 14-fullerene_unpacked.01-gs.inp
Value | Reference | Precision | Status |
-3.184210509900000e+02 | -3.184209376000000e+02 | 1.300000000000000e-04 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)