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Dissociative chemisorption(DC) is the initial and often rate-limiting step in heterogeneous catalysis.
Dynamics of carbon monoxide dissociation on Co(11(2)0)
【摘 要】
：
Dissociative chemisorption(DC) is the initial and often rate-limiting step in heterogeneous catalysis.
【机 构】
：
InstituteofTheoreticalandComputationalChemistry,KeyLaboratoryofMesoscopicChemistry,SchoolofChemistry
【出 处】
：
中国化学会第14 届全国计算(机)化学学术会议暨分子模拟国际论坛
【发表日期】
：
2017年11期
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会议
本报告介绍基于在线计算网站xyzgate.com 的计算化学研究，主要以生物分子的PB 静电计算模拟作为例子.在线计算具有多方面的优点，如方便自由地开辟和关闭计算节点，计算、分析