Communication: Constrained molecular dynamics for polarizable models-Reference-Cited by-同舟云学术

Communication: Constrained molecular dynamics for polarizable models

Published:2018-11-21 Issue:19 Volume:149 Page:191102
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:J. Chem. Phys.

Author:

Coretti Alessandro¹,Bonella Sara²^ORCID,Ciccotti Giovanni³^ORCID

Affiliation:

1. Department of Mathematical Sciences, Politecnico di Torino, Corso Duca degli Abruzzi 24, I-10129 Torino, Italy

2. Centre Européen de Calcul Atomique et Moléculaire (CECAM), École Polytechnique Fédérale de Lausanne, Batochime, Avenue Forel 2, 1015 Lausanne, Switzerland

3. Institute for Applied Computing “Mauro Picone” (IAC), CNR Via dei Taurini 19, 00185 Rome, Italy

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.5055704

Reference26 articles.

1. Interatomic Potentials in Solid State Chemistry

2. Theory of the Dielectric Constants of Alkali Halide Crystals

3. Quadrupole Polarization in Simulations of Ionic Systems: Application to AgCl

4. Molecular dynamics simulations of compressible ions

5. A polarizable model for water using distributed charge sites

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