【序号】:1
【作者】:Kikyung Nam
【题名】:Direct ab initio dynamics calculations for rates and the kinetic isotope effects of multiproton transfer in ClONO2+HCl→HNO3+Cl2 reactions with water clusters: Breakdown of the rule of the geometric mean
【期刊】:JCP
【全文】:http://jcp.aip.org/resource/1/jcpsa6/v130/i14/p144310_s1?isAuthorized=no
【序号】:2
【作者】:Hua-Gen Yu
【题名】:Ab initio and direct dynamics study of the reaction of Cl atoms with HOCO
【期刊】:JCP
【全文】:http://jcp.aip.org/resource/1/jcpsa6/v129/i6/p064301_s1?isAuthorized=no
【序号】:3
【题名】:Ab initio direct dynamics studies on the reactions of H atoms with CH3Cl and CH3Br
【期刊】:JCP
【全文】:http://jcp.aip.org/resource/1/jcpsa6/v118/i11/p4920_s1?isAuthorized=no