Efficient computation of Coulomb and exchange integrals for multi-million atom nanostructures

DOI10.1016/J.CPC.2018.12.011OpenAlexW2907572401WikidataQ110111339 ScholiaQ110111339MaRDI QIDQ6042342

Piotr T. Różański, Michał Zieliński

Publication date: 10 May 2023

Published in: Computer Physics Communications (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1016/j.cpc.2018.12.011

zbMATH Keywords

fast Fourier transformquantum dotslinear scalingatomistic calculations

Mathematics Subject Classification ID

Biology and other natural sciences (92-XX) Operations research, mathematical programming (90-XX)

Cites Work

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