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Kinetic studies of the reaction NH2+H2S

✍ Scribed by Gao, Yide; Marshall, Paul


Book ID
122334583
Publisher
Elsevier Science
Year
2014
Tongue
English
Weight
482 KB
Volume
594
Category
Article
ISSN
0009-2614

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The geometries of the reactant, products, and transition state of the title reaction were optimized at the UHF and UMP2 levels with the double and triple zeta basis sets as well as polarization functions by using the energy-gradient method. The potential-energy barrier for this reaction is 3.73 kcal