Ontology highlight
ABSTRACT:
SUBMITTER: Kopula Kesavan J
PROVIDER: S-EPMC7075158 | biostudies-literature | 2020 Feb
REPOSITORIES: biostudies-literature
Kopula Kesavan Jagadesh J d'Acapito Francesco F Scardi Paolo P Stavrinadis Alexandros A Akgul Mehmet Zafer MZ Burgués-Ceballos Ignasi I Konstantatos Gerasimos G Boscherini Federico F
Nanomaterials (Basel, Switzerland) 20200212 2
By combining X-ray absorption fine structure and X-ray diffraction measurements with density functional and molecular dynamics simulations, we study the structure of a set of Ag<sub>x</sub>Bi<sub>1-x</sub>S<sub>2</sub> nanoparticles, a materials system of considerable current interest for photovoltaics. An apparent contradiction between the evidence provided by X-ray absorption and diffraction measurements is solved by means of the simulations. We find that disorder in the cation sublattice indu ...[more]