Preprint
Aug 2026
Finite-Temperature Thermodynamics of Cu(100) Oxidation: Missing-Row Reconstruction, Defect States, and Order-Disorder Transition from Nested Sampling
Metal surfaces undergo structural, compositional, and morphological changes in response to their chemical environment. Tuning the surfaces'function and stability for a given application correspondingly necessitates an understanding of how this surface evolution couples to external conditions. Here, we demonstrate the f...
F. Riccius, Karsten Reuter, H. Heenen et al.
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