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A theoretical study on the hydrolysis mechanism of carbon disulfide

✍ Scribed by Lixia Ling; Riguang Zhang; Peide Han; Baojun Wang

Book ID
113053289
Publisher
Springer-Verlag
Year
2011
Tongue
English
Weight
245 KB
Volume
18
Category
Article
ISSN
1610-2940

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✍ Zheng-wang Qu; Hui Zhu; Ze-sheng Li; Qi-yuan Zhang πŸ“‚ Article πŸ“… 2002 πŸ› John Wiley and Sons 🌐 English βš– 165 KB

## Abstract The complex potential energy surface of the gas‐phase reaction of HB(H)BH^βˆ’^ with CS~2~ to give three low‐lying products [B~2~H~3~S]^βˆ’^+CS, [BH~2~CS]^βˆ’^+HBS, and [BH~3~CS]+BS^βˆ’^, involving nine [B~2~H~3~CS~2~]^βˆ’^ isomers and 12 transition states, has been investigated at the CCSD(T)/6‐3