Potential of mean force calculations using ab initio tight-binding molecular dynamics: Application to N–NO2 bond dissociation in DMNA and HMX
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference31 articles.
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2. Ab initio multireference configuration interaction study of CH2NNO2. HONO elimination vs NN bond fragmentation
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5. Alkaline Hydrolysis of the Cyclic Nitramine Explosives RDX, HMX, and CL-20: New Insights into Degradation Pathways Obtained by the Observation of Novel Intermediates
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