Smooth particle mesh Ewald-integrated stochastic Lanczos many-body dispersion algorithm
Author:
Affiliation:
1. Laboratoire de Chimie Théorique, Sorbonne Université 1 , 75005 Paris, France
2. Sorbonne Université, IP2CT, FR 2622 CNRS 2 , Paris, France
3. Department of Biomedical Engineering, The University of Texas at Austin 3 , Austin, Texas 78712, USA
Abstract
Funder
HORIZON EUROPE European Research Council
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
https://pubs.aip.org/aip/jcp/article-pdf/doi/10.1063/5.0166476/18177752/154109_1_5.0166476.pdf
Reference37 articles.
1. Dispersion-corrected mean-field electronic structure methods;Chem. Rev.,2016
2. Many-body effects of dispersion interaction;J. Chem. Phys.,2006
3. Long-range correlation energy calculated from coupled atomic response functions;J. Chem. Phys.,2014
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