AMBER-ii: New Combining Rules and Force Field for Perfluoroalkanes
Author:
Affiliation:
1. Engelhardt Institute of Molecular Biology, Russian Academy of Sciences, Moscow 119991, Russia
2. Division of Physical Chemistry, Department of Materials and Environmental Chemistry, Stockholm University, Stockholm SE-10691, Sweden
Funder
Russian Academy of Sciences
Vetenskapsrådet
Russian Foundation for Basic Research
Publisher
American Chemical Society (ACS)
Subject
Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jpcb.5b07233
Reference55 articles.
1. Modern Fluoroorganic Chemistry
2. Characteristics of C-F Systems
3. Physical Chemistry of Fluorocarbons
4. Perfluoroalkanes: Conformational Analysis and Liquid-State Properties from ab Initio and Monte Carlo Calculations
5. Anti, Ortho, and Gauche Conformers of Perfluoro-n-butane: Matrix-Isolation IR Spectra and Calculations
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