Complete Basis Set Extrapolation of Electronic Correlation Energies Using the Riemann Zeta Function
Author:
Affiliation:
1. Faculty of Chemistry, University of Warsaw, Pasteura 1, 02-093 Warsaw, Poland
Funder
Narodowe Centrum Nauki
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.9b00705
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4. Extrapolating to the one-electron basis-set limit in electronic structure calculations
5. Straightening the Hierarchical Staircase for Basis Set Extrapolations: A Low-Cost Approach to High-Accuracy Computational Chemistry
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