FIRST PRINCIPLE CALCULATION WITH INTERPOLATING SCALING FUNCTION ON ADAPTIVE GRIDDING

DOI10.1142/S0129183107011650MaRDI QIDQ3500223zbMATH OpenOpenAlexFDO

Authors Wang-Chuang Kuo, Jen-Chung Wang

Publication date 3 June 2008

Published in International Journal of Modern Physics C (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1142/s0129183107011650

zbMATH Keywords

adaptive griddingfirst principle calculationinterpolating scaling functionKohn-Sham equationlocal density approximationmulti-resolution

Mathematics Subject Classification ID

Multigrid methods; domain decomposition for boundary value problems involving PDEs (65N55) Combustion (80A25)

Recommendations

• Multiscale computation with interpolating wavelets
• Interpolation based local postprocessing for adaptive finite element approximations in electronic structure calculations
• An application of the interpolating scaling functions to wave packet propagation
• Electronic structure calculations using self-adaptive multiscale Voronoi basis functions
• Wavelets for density matrix computation in electronic structure calculation

Cites work

• HARES: An efficient method for first-principles electronic structure calculations of complex systems
• Multiscale computation with interpolating wavelets
• Ten Lectures on Wavelets

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