Polarizable Force Field for Acetonitrile Based on the Single-Center Multipole Expansion
Author:
Affiliation:
1. Science Institute and Faculty of Physical Sciences, University of Iceland VR-III, 107Reykjavík, Iceland
Funder
Icelandic Centre for Research
Danmarks Frie Forskningsfond
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.2c04255
Reference64 articles.
1. Precision measurement of dipole moments and other spectral constants of normal and deuterated methyl fluoride and methyl cyanide
2. Far-infrared optical constants of liquid acetonitrile at 238 to 343 K as measured with a synchrotron radiation source
3. Unusual Stability of Acetonitrile-Based Superconcentrated Electrolytes for Fast-Charging Lithium-Ion Batteries
4. Acetonitrile Transition Metal Interfaces from First Principles
5. α-Acetonitrile at 215 K
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