PHYSICAL REVIEW B 100, 075146 (2019) Charge-transfer effect in hard x-ray 1s and 2p photoemission spectra: LDA+DMFT and cluster-model analysis

Mahnaz Ghiasi,1 Atsushi Hariki,2 Mathias Winder,2 Jan Kuneš,2,3 Anna Regoutz,4 Tien-Lin Lee,5 Yongfeng Hu,6 Jean-Pascal Rueff,7,8 and Frank M. F. de Groot1 1Inorganic Chemistry & Catalysis, Debye Institute for Nanomaterials Science, Utrecht University, Universiteitsweg 99, 3584 CG, Utrecht, The Netherlands 2Institute of Solid State Physics, TU Wien, 1040 Vienna, Austria 3Institute of Physics, Czech Academy of Sciences, Na Slovance 2, 182 21 Praha 8, Czechia 4Department of Materials, Imperial College London, Exhibition Road, London SW7 2AZ, United Kingdom 5Diamond Light Source, Didcot, OX11 0DE, United Kingdom 6Canadian Light Source, Saskatoon, SK S7N 2V3, Canada 7Synchrotron SOLEIL, l’Orme des Merisiers, Saint-Aubin, BP 48, F-91192 Gif-sur-Yvette Cedex, France 8Sorbonne Université, CNRS, Laboratoire de Chimie Physique-Matière et Rayonnement, LCPMR, F-75005 Paris, France