Match Hartree-Fock energy
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda] >
Input 02-xc_2d.02-hf.inp
Value | Reference | Precision | Status |
3.718757300000000e-01 | 3.718757300000000e-01 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)