Is the divide-and-conquer Hartree–Fock method valid for calculations of delocalized systems?
Author:
Publisher
Informa UK Limited
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Molecular Biology,Biophysics
Link
http://www.tandfonline.com/doi/pdf/10.1080/00268970701642267
Reference29 articles.
1. Derivation and efficient implementation of the fast multipole method
2. Achieving Linear Scaling for the Electronic Quantum Coulomb Problem
3. Linear scaling computation of the Hartree–Fock exchange matrix
4. A linear scaling method for Hartree–Fock exchange calculations of large molecules
5. Linear and sublinear scaling formation of Hartree–Fock-type exchange matrices
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