摘要
利用热力学基础数据和相关软件对Co-Mo-K催化剂上COS、HCN加氢和水解反应进行了热力学计算。在热力学上,COS、HCN加氢和水解反应在耐硫变换条件下均为自发过程。计算结果表明在Co-Mo-K耐硫变换条件下COS、HCN主要发生的是水解反应,该结果与工业经验数据基本一致,可以作为工业实际借鉴。
The thermodynamics equilibrium conversion of COS and HCN on Co-Mo-K catalyst were calculated according to some thermodynamic data and related software. The hydrogenation and hydrolysis of COS, HCN can occur spontaneously under the conditions of sulfur tolerant shift reaction because of the low negative value of AG thermodynamicaUy. The calculation reveal that COS, HCN hydrolyzing is the main reaction under the conditions of sulfur tolerant shift reaction in accord with empirical data of industrial.
出处
《计算机与应用化学》
CAS
CSCD
北大核心
2014年第9期1119-1121,共3页
Computers and Applied Chemistry
基金
武汉理工大学华夏学院科研基金项目(13013)