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Simulation of surface resonant X-ray diffraction

Joly Y., Abisset A., Bailly A., De Santis M., Fettar F., Grenier S., Mannix D., Ramos A.Y., Saint-Lager M.C., Soldo-Olivier Y., Tonnerre J.M., Guda S.A., Gründer Y.,
Journal of Chemical Theory and Computation 14, 973-980 (2018)