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Ion Solvation and Transport in Narrow Carbon Nanotubes: Effects of Polarizability, Cation-π Interaction, and Confinement.

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Bibliographic Details
Title: Ion Solvation and Transport in Narrow Carbon Nanotubes: Effects of Polarizability, Cation-π Interaction, and Confinement.
Authors: Aydin F; Quantum Simulations Group, Materials Science Division, Lawrence Livermore National Laboratory, 7000 East Ave, Livermore, California 94550, United States., Moradzadeh A; Department of Mechanical Science and Engineering, University of Illinois at Urbana-Champaign, Urbana, Illinois 61801, United States., Bilodeau CL; Department of Chemical and Biological Engineering and Center for Biotechnology and Interdisciplinary Studies, Rensselaer Polytechnic Institute, Troy, New York 12180, United States., Lau EY; Biosciences and Biotechnology Division, Lawrence Livermore National Laboratory, 7000 East Ave, Livermore, California 94550, United States., Schwegler E; Quantum Simulations Group, Materials Science Division, Lawrence Livermore National Laboratory, 7000 East Ave, Livermore, California 94550, United States., Aluru NR; Department of Mechanical Science and Engineering, University of Illinois at Urbana-Champaign, Urbana, Illinois 61801, United States., Pham TA; Quantum Simulations Group, Materials Science Division, Lawrence Livermore National Laboratory, 7000 East Ave, Livermore, California 94550, United States.
Source: Journal of chemical theory and computation [J Chem Theory Comput] 2021 Mar 09; Vol. 17 (3), pp. 1596-1605. Date of Electronic Publication: 2021 Feb 24.
Publication Type: Journal Article
Journal Info: Publisher: American Chemical Society Country of Publication: United States NLM ID: 101232704 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1549-9626 (Electronic) Linking ISSN: 15499618 NLM ISO Abbreviation: J Chem Theory Comput Subsets: MEDLINE; PubMed not MEDLINE
Database: MEDLINE Ultimate
Description
ISSN:1549-9626
DOI:10.1021/acs.jctc.0c00827