𝔖 Bobbio Scriptorium
✦   LIBER   ✦

CVD Reactions of TiCl4 with Ammonia: a Quantum Chemical Study

✍ Scribed by Ting-Ting Huang; Kai Tan; Meng-Hai Lin; Qian-Er Zhang

Publisher
John Wiley and Sons
Year
2007
Tongue
English
Weight
84 KB
Volume
25
Category
Article
ISSN
0256-7660

No coin nor oath required. For personal study only.

πŸ“œ SIMILAR VOLUMES

Quantum chemical study of the reaction o
Quantum chemical study of the reaction of NH4+ with alkylmercury halides in the gas phase
✍ Dmitri C. Zagorevskii; Yuri S. Nekrasov; Nikolai I. Raevski πŸ“‚ Article πŸ“… 1992 πŸ› John Wiley and Sons 🌐 English βš– 289 KB

## Calculations on the thermochemistry of reactions between NH,' ions and EtHgX molecules (X = C1, Br, I) were performed by the MNDO method. The calculations showed the p i b l e existence of two stable isomers of composition [ EtHgX, NH, 1 + namely [ EtHgX -.HNH, 1 + and [ EtHg(NH,)XH I +. Proton

Quantum chemical study on the reaction m
Quantum chemical study on the reaction mechanism of OBrO radical with OH radical
✍ Min Zhao; Yan-Ling Zhao; Peng-Jun Liu; Ying-Fei Chang; Xiu-Mei Pan; Zhong-Min Su πŸ“‚ Article πŸ“… 2010 πŸ› John Wiley and Sons 🌐 English βš– 374 KB πŸ‘ 2 views

## Abstract The reaction mechanism of OBrO with OH has been studied using the B3LYP/6‐311+G(d,p) and the high‐level electron‐correlation CCSD(T)/6‐311+G(d,p) at single‐point. The results show that the title reaction could probably proceed by four possible schemes, generating HOBr+O~2~, HBr+O~3~, Br

Thermodynamics and kinetics of initial g
Thermodynamics and kinetics of initial gas phase reactions in chemical vapor deposition of titanium nitride. Theoretical study of TiCl4 ammonolysis
✍ Stanislav Ya. Umanskii; Konstantin P. Novoselov; Airat Kh. Minushev; Magdalena S πŸ“‚ Article πŸ“… 2001 πŸ› John Wiley and Sons 🌐 English βš– 204 KB

## Abstract Thermodynamic equilibrium and kinetics of the gas‐phase reaction between TiCl~4~ and NH~3~ have been studied computationally using results from recent quantum mechanical calculations of titanium tetrachloride ammonolysis.1 These calculations were based upon the transition state theory f