A molecular dynamics study of 1,1-diamino-2,2-dinitroethylene (FOX-7) crystal using a symmetry adapted perturbation theory-based intermolecular force field†
Abstract
A dimer potential energy function for
* Corresponding authors
a
The Army Research Laboratory, Aberdeen Proving Ground, Maryland, USA
E-mail:
decarlos.taylor@us.army.mil, betsy.rice@us.army.mil
b
Department of Physics and Astronomy, University of Delaware, Newark, Delaware, USA
E-mail:
frob@udel.edu, szalewic@udel.edu
c
Institute of Chemistry, University of Silesia, Poland
E-mail:
poszwa@tiger.chem.uw.edu.pl
A dimer potential energy function for
D. E. Taylor, F. Rob, B. M. Rice, R. Podeszwa and K. Szalewicz, Phys. Chem. Chem. Phys., 2011, 13, 16629 DOI: 10.1039/C1CP21342C
To request permission to reproduce material from this article, please go to the Copyright Clearance Center request page.
If you are an author contributing to an RSC publication, you do not need to request permission provided correct acknowledgement is given.
If you are the author of this article, you do not need to request permission to reproduce figures and diagrams provided correct acknowledgement is given. If you want to reproduce the whole article in a third-party publication (excluding your thesis/dissertation for which permission is not required) please go to the Copyright Clearance Center request page.
Read more about how to correctly acknowledge RSC content.
Fetching data from CrossRef.
This may take some time to load.
Loading related content