Ising-like models for stacking faults in a free electron metal

DOI10.1098/rspa.2020.0319zbMath1472.82007OpenAlexW3095135014WikidataQ102211286 ScholiaQ102211286MaRDI QIDQ5161123

Anthony T. Paxton, Eleftherios I. Andritsos, Martina Ruffino, Guy C. G. Skinner

Publication date: 29 October 2021

Published in: Proceedings of the Royal Society A: Mathematical, Physical and Engineering Sciences (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1098/rspa.2020.0319

zbMATH Keywords

convergencetotal energyprecisionelectronic structureatomic and molecular physicssolid-state physicslow-temperature physicsMagnesiumstacking faults

Mathematics Subject Classification ID

Lattice systems (Ising, dimer, Potts, etc.) and systems on graphs arising in equilibrium statistical mechanics (82B20)

Cites Work

• Questaal: a package of electronic structure methods based on the linear muffin-tin orbital technique
• Beitrag zur Theorie des Ferromagnetismus
• General Theory of Pseudopotentials
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