A combined theoretical and experimental study of sarin (GB) decomposition at high temperatures

Theoretical and experimental results are presented for the pyrolytic decomposition of the nerve agent sarin (GB) in the gas phase. High level quantum chemistry calculations are performed together with a semiclassical transition state theory for describing quantum mechanical tunneling. The experiment...

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Bibliographic Details
Main Authors: Shan, X, Vincent, JC, Kirkpatrick, S, Walker, MD, Sambrook, MR, Clary, DC
Format: Journal article
Published: American Chemical Society 2017