Match N_electrons [step 500]
Commits >
Commit 8ce473bc2e5cdca8ff24e2d00f27e291b995e815 >
Run intel_mpi_autotools: [intel2023a-mpi] >
Input 04-lithium.02-absorbing_boundaries.inp
Value | Reference | Precision | Status |
2.319032381890960e+00 | 2.319032630881478e+00 | 3.060000000000000e-07 | PASS |
Command: LINEFIELD(td.general/norm_wavefunctions, 507, 3)