Improved Fast Randomized Iteration Approach to Full Configuration Interaction-Reference-Cited by-同舟云学术

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Improved Fast Randomized Iteration Approach to Full Configuration Interaction

Published:2020-07-22 Issue:9 Volume:16 Page:5572-5585
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Greene Samuel M.¹^ORCID,Webber Robert J.²,Weare Jonathan²,Berkelbach Timothy C.¹³^ORCID

Affiliation:

1. Department of Chemistry, Columbia University, New York, New York 10027, United States

2. Courant Institute of Mathematical Sciences, New York University, New York, New York 10012, United States

3. Center for Computational Quantum Physics, Flatiron Institute, New York, New York 10010, United States

Funder

Division of Mathematical Sciences

University of Chicago

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.0c00437

Reference69 articles.

1. Transition Metal Oxides

2. An overview of strongly correlated electron systems

3. NIC Series;Assaad F. F.,2006

4. Challenges in the use of density functional theory to examine catalysis by M-doped ceria surfaces

5. Introduction

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1. Toward Accurate Spin–Orbit Splittings from Relativistic Multireference Electronic Structure Theory;The Journal of Physical Chemistry Letters;2024-07-02

2. Distributed Implementation of Full Configuration Interaction for One Trillion Determinants;Journal of Chemical Theory and Computation;2024-02-05

3. Exploiting Locality in Full Configuration Interaction Quantum Monte Carlo for Fast Excitation Generation;Journal of Chemical Theory and Computation;2023-12-05

4. Full Configuration Interaction Excited-State Energies in Large Active Spaces from Subspace Iteration with Repeated Random Sparsification;Journal of Chemical Theory and Computation;2022-11-08

5. Approximating Matrix Eigenvalues by Subspace Iteration with Repeated Random Sparsification;SIAM Journal on Scientific Computing;2022-09-26

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