Density matrix search using direct inversion in the iterative subspace as a linear scaling alternative to diagonalization in electronic structure calculations-Reference-Cited by-同舟云学术

Density matrix search using direct inversion in the iterative subspace as a linear scaling alternative to diagonalization in electronic structure calculations

Published:2003-10-15 Issue:15 Volume:119 Page:7651-7658
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Li Xiaosong,Millam John M.,Scuseria Gustavo E.,Frisch Michael J.,Schlegel H. Bernhard

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.1607961

Reference41 articles.

1. A fast algorithm for particle simulations

2. Achieving Linear Scaling for the Electronic Quantum Coulomb Problem

3. Linear scaling density functional calculations via the continuous fast multipole method

4. Derivation and efficient implementation of the fast multipole method

5. Linear scaling computation of the Hartree–Fock exchange matrix

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