forthcoming articles
The following articles are a selection of those recently accepted for publication in Acta Crystallographica Section A: Foundations and Advances.
See also Forthcoming articles in all IUCr journals.
research papers
N-representable one-electron reduced density matrix reconstruction with frozen core electrons
An improved method of one-electron reduced density matrix reconstruction from structure factors and directional Compton profiles is tested on a urea crystal. Novel restrictions accounting for molecular symmetry and freezing of core electrons are introduced.