Fully Internally Contracted Multireference Configuration Interaction Theory Using Density Matrix Renormalization Group: A Reduced-Scaling Implementation Derived by Computer-Aided Tensor Factorization-Reference-Cited by-同舟云学术

Fully Internally Contracted Multireference Configuration Interaction Theory Using Density Matrix Renormalization Group: A Reduced-Scaling Implementation Derived by Computer-Aided Tensor Factorization

Published:2015-10-13 Issue:11 Volume:11 Page:5120-5131
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Saitow Masaaki¹,Kurashige Yuki¹²³,Yanai Takeshi¹²

Affiliation:

1. The Graduate University for Advanced Studies, Myodaiji, Okazaki, Aichi 444-8585, Japan

2. Department of Theoretical and Computational Molecular Science, Institute for Molecular Science, Okazaki, Aichi 444-8585, Japan

3. Japan Science and Technology Agency, PRESTO, 4-1-8 Honcho, Kawaguchi, Saitama 332-0012, Japan

Funder

Ministry of Education, Culture, Sports, Science, and Technology

Morino Foundation for Molecular Science

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.5b00270

Reference173 articles.

1. Density matrix formulation for quantum renormalization groups

2. Density-matrix algorithms for quantum renormalization groups

3. Ab initio quantum chemistry using the density matrix renormalization group

4. Full-CI quantum chemistry using the density matrix renormalization group

5. Quantum chemistry using the density matrix renormalization group

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