Approximation of the electron density of aluminium clusters in tensor-product format
DOI10.1016/J.JCP.2011.12.009zbMATH Open1245.82078OpenAlexW2097681964MaRDI QIDQ419613FDOQ419613
Authors: T. Blesgen, V. Gavini, V. Khoromskaia 
Publication date: 18 May 2012
Published in: Journal of Computational Physics (Search for Journal in Brave)
Full work available at URL: https://doi.org/10.1016/j.jcp.2011.12.009
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finite elementsorbital-free density functional theoryaluminium clusterselectron densitymultigrid accelerated tensor approximationTucker-type decomposition
Multigrid methods; domain decomposition for boundary value problems involving PDEs (65N55) PDEs in connection with quantum mechanics (35Q40) Finite element, Rayleigh-Ritz and Galerkin methods for boundary value problems involving PDEs (65N30) Statistical mechanics of metals (82D35)
Cites Work
- Tensor Decompositions and Applications
- A Multilinear Singular Value Decomposition
- On the Best Rank-1 and Rank-(R1 ,R2 ,. . .,RN) Approximation of Higher-Order Tensors
- On tensor approximation of Green iterations for Kohn-Sham equations
- Non-periodic finite-element formulation of orbital-free density functional theory
- Non-periodic finite-element formulation of Kohn-Sham density functional theory
- Simplicial grid refinement: On Freudenthal's algorithm and the optimal number of congruence classes
- Computation of the Hartree-Fock exchange by the tensor-structured methods
- Low rank Tucker-type tensor approximation to classical potentials
- Numerical solution of the Hartree-Fock equation in multilevel tensor-structured format
- Multigrid accelerated tensor approximation of function related multidimensional arrays
- Fast and accurate tensor approximation of a multivariate convolution with linear scaling in dimension
- Quasi-continuum orbital-free density-functional theory: a route to multi-million atom non-periodic DFT calculation
- Tensor-product approximation to operators and functions in high dimensions
Cited In (6)
- Cross approximation in tensor electron density computations
- Grid-based electronic structure calculations: the tensor decomposition approach
- Computing the density of states for optical spectra of molecules by low-rank and QTT tensor approximation
- TTDFT: a GPU accelerated Tucker tensor DFT code for large-scale Kohn-Sham DFT calculations
- Fast and accurate 3D tensor calculation of the Fock operator in a general basis
- A literature survey of low-rank tensor approximation techniques
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