Newnham, JonZhao, TianqiGibson, QuinnManning, Troy D.Zanella, MarcoMariani, ElisabettaDaniels, Luke MAlaria, JonathanClaridge, John BCorà, FurioRosseinsky, Matthew J.2025-10-012022-10-05Newnham, J, Zhao, T, Gibson, Q, Manning, T D, Zanella, M, Mariani, E, Daniels, L M, Alaria, J, Claridge, J B, Corà, F & Rosseinsky, M J 2022, 'Band Structure Engineering of Bi4O4SeCl2 for Thermoelectric Applications', ACS Organic & Inorganic Au, vol. 2, no. 5, pp. 405–414. https://doi.org/10.1021/acsorginorgau.2c00018ORCID: /0000-0002-8408-7232/work/116032100ORCID: /0000-0001-7020-199X/work/193595791https://hdl.handle.net/2164/26128This work used the ARCHER UK National Supercomputing Service (http://www.archer.ac.uk). Dave Atkinson is thanked for assistance with sample polishing for EBSD.103815693engthermoelectricelectronic structuredopingscreeningmultianiondisproportionateBi4O4SeCl2QD ChemistryQDJournal article10.1021/acsorginorgau.2c00018