Match Hartree-Fock energy Total
Commits >
Commit 6873b983d1904fe0612bd483f61737dd2d8ed971 >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] >
Input 03-xc.01-gs.inp
Value | Reference | Precision | Status |
-7.075775000000000e-01 | -7.075695600000000e-01 | 8.729999999999999e-06 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)