Atomic cluster expansion without self-interaction

DOI10.1016/J.JCP.2024.113271MaRDI QIDQ6614977zbMATH OpenFDO

Authors Timon S. Gutleb, C. Ortner

Publication date 8 October 2024

Published in Journal of Computational Physics (Search for Journal in Brave)

Mathematics Subject Classification ID

Numerical methods for partial differential equations, boundary value problems (65Nxx) Approximations and expansions (41Axx) Applications of quantum theory to specific physical systems (81Vxx)

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Cites work

• scientific article; zbMATH DE number 3139869 (Why is no real title available?)
• scientific article; zbMATH DE number 3180958 (Why is no real title available?)
• A Multilevel Method for Many-Electron Schrödinger Equations Based on the Atomic Cluster Expansion
• A theoretical case study of the generalization of machine-learned potentials
• Atomic cluster expansion: completeness, efficiency and stability
• Linearization of the Product of Jacobi Polynomials. I
• Locality of interatomic forces in tight binding models for insulators
• Machine Learning and Invariant Theory
• Multivariate polynomial approximation in the hypercube
• On Polynomial Multiplication in Chebyshev Basis
• On the stability and accuracy of least squares approximations
• Polynomial approximation of symmetric functions
• QM/MM methods for crystalline defects. I: Locality of the tight binding model

Cited in

(1)

• A Multilevel Method for Many-Electron Schrödinger Equations Based on the Atomic Cluster Expansion

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