Pair Densities in Density Functional Theory

DOI10.1137/15M1014024zbMath1328.35189arXiv1503.07539MaRDI QIDQ3459655

Huajie Chen, Gero Friesecke

Publication date: 11 January 2016

Published in: Multiscale Modeling & Simulation (Search for Journal in Brave)

Full work available at URL: https://arxiv.org/abs/1503.07539

zbMATH Keywords

asymptotics; density functional theory; pair density; density-to-pair-density map

Mathematics Subject Classification ID

81V05: Strong interaction, including quantum chromodynamics

35Q40: PDEs in connection with quantum mechanics

65N25: Numerical methods for eigenvalue problems for boundary value problems involving PDEs

65K99: Numerical methods for mathematical programming, optimization and variational techniques

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Cites Work

• Symmetric Monge-Kantorovich problems and polar decompositions of vector fields
• Pair correlations and exchange phenomena in the free electron gas
• The geometry of optimal transportation
• Polar factorization and monotone rearrangement of vector‐valued functions
• Optimal maps for the multidimensional Monge-Kantorovich problem
• Density Functional Theory and Optimal Transportation with Coulomb Cost
• Multimarginal Optimal Transport Maps for One–dimensional Repulsive Costs
• Optimal Transport