The ENUF method—Ewald summation based on nonuniform fast Fourier transform: Implementation, parallelization, and application

Author:

Yang Sheng‐Chun1,Li Bin2,Zhu You‐Liang3,Laaksonen Aatto4567,Wang Yong‐Lei4ORCID

Affiliation:

1. School of Computer ScienceNortheast Electric Power University Jilin China

2. School of Chemical Engineering and TechnologySun Yat‐sen University Zhuhai China

3. State Key Laboratory of Polymer Physics and ChemistryChangchun Institute of Applied Chemistry, Chinese Academy of Sciences Changchun China

4. Department of Materials and Environmental Chemistry, Arrhenius LaboratoryStockholm University Stockholm Sweden

5. State Key Laboratory of Materials‐Oriented and Chemical EngineeringNanjing Tech University Nanjing China

6. Centre of Advanced Research in Bionanoconjugates and BiopolymersPetru Poni Institute of Macromolecular Chemistry Aleea Grigore Ghica‐Voda Iasi Romania

7. Department of Engineering Sciences and Mathematics, Division of Energy ScienceLuleå University of Technology Luleå Sweden

Funder

Fundamental Research Funds for the Central Universities

Knut och Alice Wallenbergs Stiftelse

National Natural Science Foundation of China

Vetenskapsrådet

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

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