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名称:中国化学会
省份:北京市

体彩11选五走势图山西:第十三届全国量子化学会议论文集——第三分会:量子、经典和统计反应动力学

会议论文
Convergence of high order perturbative expansions in open system quantum dynamics
Effect of hydrogen adsorption on morphology changes of Fcc-Co surfaces structures: theoretical study Mengting Yu;Qiang Wang;Bo Hou;
Effect of Coverage on CO and H_2 Adsorption and Dissociation over Pd(111) Surface Danli Liang;Riguang Zhang;Lixia Ling;Baojun Wang;
Effect of Cu Cluster Size on Selectivity and Activity of Acetylene Selective Hydrogenation Bo Zhao;Riguang Zhang;Baojun Wang;
Insights into the Preferential Mechanism of C–C Chain Growth in FTS on Hcp Co(10-10)-A Surface Hongxia Liu;Riguang Zhang;Baojun Wang;
Density functional theory study on the mechanism of CO_2 capture by K_2CO_3/TiO_2 Qiaoyun Qin;Hongyan Liu;Baojun Wang;
Modification of Active Site for CO_2 Hydrogenation on Cu(211) Surface by Doping Transition Metals Mao Peng;Riguang Zhang;Baojun Wang;
Theoretical study of palladium-catalyzed sp~3 N-H bond activation oxidative carbonylation of hydrazides Changhua Li;Ying Ren;Jianfeng Jia;Haishun Wu;
A DFT study on the reaction mechanisms of alkene dehydrogenative silylation catalayzed by bis(imino) pyridine cobalt complex Dandan Yang;Hai-Yu Li;Cai-Hong Guo;Hai-Shun Wu;
18电子规则极限:密度泛函研究MO(CO)_n~+(M=Sc,Y,La)的几何演变 董扬;刘志凌;张娜;贾建峰;武海顺;
The Study of C~+ + H_2 and Its Isotopic Reaction with Time-dependent Wave Packet Method Aijie Zhang;Jin Guo;Yong Zhou;Jianfeng Jia;Haishun Wu;
单原子铁催化剂吸附气体污染物的理论研究 高正阳;胡红修;杨维结;阎维平;
钯催化C-H键活化/S_N2-环氧烷开环反应的理论研究 连冰;方德彩;
Density Functional Theory Study On Acetylene Hydrogenation over Ni and NiGa intermetallic Catalysts De-Ming Rao;Tao Sun;Hui-Min Liu;Hong Yan;Min Wei;
Predicting the structural and electronic properties of transition metal monoxides from bulk to surface morphology Jin-Jia Liu;Xiao-Dong Wen;
CO Adsorption and Dissociation on Fe_5C_2 Surfaces: A DFT Study Yurong He;Wenping Guo;Chun-Fang Huo;Xiao-Dong Wen;Yong-Wang Li;
Simulation study of organic semiconductor copper phthalocyanine vapor growth on the SiO_2 surface Huayuan Bai;Yi Liao;
纳米金催化中动态单原子的理论研究 刘锦程;王阳刚;李隽;
MS-CASPT2-based Nonadiabatic Dynamics Simulations at QM and QM/MM Levels Xiang-Yang Liu;Bin-Bin Xie;Wei-Hai Fang;Ganglong Cui;
铑催化氧化C-H烯丙基化反应机理的理论研究 姚立峰;方德彩;
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