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Title: First-principles molecular dynamics simulations of condensed phase V-type nerve agent reaction pathways and energy barriers

Authors:
; ; ;
Publication Date:
Research Org.:
Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States)
Sponsoring Org.:
USDOE
OSTI Identifier:
1184114
Report Number(s):
LLNL-JRNL-491161
DOE Contract Number:  
DE-AC52-07NA27344
Resource Type:
Journal Article
Journal Name:
Physical Chemistry Chemical Pysics, vol. 14, no. 10, January 5, 2012, pp. 3316-3322
Additional Journal Information:
Journal Name: Physical Chemistry Chemical Pysics, vol. 14, no. 10, January 5, 2012, pp. 3316-3322
Country of Publication:
United States
Language:
English
Subject:
71 CLASSICAL AND QUANTUMM MECHANICS, GENERAL PHYSICS; 37 INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL CHEMISTRY

Citation Formats

Gee, R H, Kuo, I W, Chinn, S C, and Raber, E. First-principles molecular dynamics simulations of condensed phase V-type nerve agent reaction pathways and energy barriers. United States: N. p., 2011. Web.
Gee, R H, Kuo, I W, Chinn, S C, & Raber, E. First-principles molecular dynamics simulations of condensed phase V-type nerve agent reaction pathways and energy barriers. United States.
Gee, R H, Kuo, I W, Chinn, S C, and Raber, E. Mon . "First-principles molecular dynamics simulations of condensed phase V-type nerve agent reaction pathways and energy barriers". United States. https://www.osti.gov/servlets/purl/1184114.
@article{osti_1184114,
title = {First-principles molecular dynamics simulations of condensed phase V-type nerve agent reaction pathways and energy barriers},
author = {Gee, R H and Kuo, I W and Chinn, S C and Raber, E},
abstractNote = {},
doi = {},
journal = {Physical Chemistry Chemical Pysics, vol. 14, no. 10, January 5, 2012, pp. 3316-3322},
number = ,
volume = ,
place = {United States},
year = {2011},
month = {7}
}