Match Total energy
Commits >
Commit 6dda27ed08cd9fd2b2f861e6109ead2bd6d3cd56 >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] >
Input 08-loewdin.02-intersite.inp
Value | Reference | Precision | Status |
-7.881822880000000e+00 | -7.881822880000000e+00 | 3.940000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)