Density functional theory direct dynamics studies on the hydrogen abstraction reactions of SiHCl3+H→SiCl3+H2 and SiH3Cl+H→SiH2Cl+H2
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Biochemistry
Reference26 articles.
1. Reaction of H atoms with some silanes and disilanes. Rate constants and Arrhenius parameters
2. Reaction path dynamics and theoretical rate constants for the SiH 3 Cl+H→SiH 2 Cl+H 2 reaction by ab initio direct dynamics method
3. High-level ab initio and density functional theory study on reaction path and rate constant of the hydrogen abstraction reaction SiH 2 Cl 2 +H→SiHCl 2 +H 2
4. Thermal and vibrational‐state selected rates of the CH4+Cl↔HCl+CH3 reaction
5. Directab initiodynamics studies of proton transfer in hydrogen‐bond systems
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1. Synthesis and optimization of low-pressure chemical vapor deposition-silicon nitride coatings deposited from SiHCl3 and NH3;Thin Solid Films;2019-07
2. Ab initio study of hydrogen abstraction reactions on toluene and tetralin;Journal of Molecular Structure: THEOCHEM;2008-02
3. Selective Alkane Transformations via Radicals and Radical Cations: Insights into the Activation Step from Experiment and Theory;Chemical Reviews;2002-04-17
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