Input 05-hartree_3d_fft.04-3d_3d_periodic.inp
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda]
Matches
Name | Value | Reference | Precision | Difference | Status |
Hartree energy (numerical) | 3.497836148181827e-01 | 3.497836148185000e-01 | 1.750000000000000e-12 | -3.173017404378697e-13 | PASS |