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Updated: Feb 27, 2026

Author Spotlight: Magnetometric Characterization of Intermediates in the Solid-State Electrochemistry of Redox-Active Metal-Organic Frameworks
Published on: June 9, 2023
Self-interaction free local exchange potentials applied to metallic systems
S J Clark1, T W Hollins1, K Refson2,3
1Department of Physics, Durham University, South Road, Durham, DH1 3LE, United Kingdom.
Abstract:
We extend the formalism of local exchange methods to calculate and investigate the electronic structure of metals. It is well-known that the Hartree-Fock method when applied to metals shows unphysical behaviour, however the accurate treatment of exchange via DFT's exact exchange method and using our local Fock exchange method can be used to describe metallic band structures accurately.
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