The Effect of the Basis-Set Superposition Error on the Calculation of Dispersion Interactions: A Test Study on the Neon Dimer-Reference-Cited by-同舟云学术

The Effect of the Basis-Set Superposition Error on the Calculation of Dispersion Interactions: A Test Study on the Neon Dimer

Published:2007-02-09 Issue:2 Volume:3 Page:477-485
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Monari Antonio¹,Bendazzoli Gian Luigi¹,Evangelisti Stefano¹,Angeli Celestino¹,Ben Amor Nadia¹,Borini Stefano¹,Maynau Daniel¹,Rossi Elda¹

Affiliation:

1. Dipartimento di Chimica Fisica e Inorganica, Universita di Bologna, Viale Risorgimento 4, I-40136 Bologna, Italy, Laboratoire de Physique Quantique, UMR 5626, Université Paul Sabatier, 118 Route de Narbonne, F-31062 Toulouse Cedex, France, Dipartimento di Chimica, Universita di Ferrara, via Borsari 46, I-44100 Ferrara, Italy, and CINECA, Consorzio Interuniversitario, via Magnanelli 6/3, I-46100 Casalecchio di Reno (BO), Italy

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/ct6003005

Reference27 articles.

1. Charged chromophoric units in protonated rare-gas clusters: A dynamical simulation

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