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High dimensional quantum dynamics studies of chemisorption of polyatomic molecules on metal surfaces 会议论文
the 2015 international chemical congress of pacific basin societies, 火奴鲁鲁, 2015-12-15
作者:  Zhang DH(张东辉)
收藏  |  浏览/下载:26/0  |  提交时间:2016/11/21
H + H2 quantum dynamics using potential energy surfaces based on the XYG3 type of doubly hybrid density functionals: Validation of the density functionals 期刊论文
journal of chemical physics, 2015, 卷号: 142, 期号: 8, 页码: 084107
作者:  Su NQ(苏乃强);  Chen J(陈俊);  Sun ZG(孙志刚);  Zhang DH(张东辉);  Xu X(徐昕)
收藏  |  浏览/下载:29/0  |  提交时间:2015/11/16
Degradation and stabilization of perovskite membranes containing silicon impurity at low temperature 期刊论文
journal of membrane science, 2015, 卷号: 492, 期号: 1, 页码: 173-180
作者:  Liu, Yan;  Zhu, Xuefeng;  Li, Mingrun;  Li, Wenping;  Yang, Weishen
收藏  |  浏览/下载:17/0  |  提交时间:2015/11/16
Quantum Dynamics Studies of Dissociation of Water on Metal Surfaces 会议论文
the 2015 gordon research conference (grc) on dynamics at surfaces, 美国, 2015-08-09
作者:  Zhang DH(张东辉)
收藏  |  浏览/下载:8/0  |  提交时间:2015/11/13
Strong Hydrogen Bond Can Enhance and Inhibit Photocatalytic Water Splitting 会议论文
2015 gordon research conference (grc) on dynamics at surfaces, 美国, 2015-08-09
作者:  Yang WS(杨文绍);  Wei D(卫东);  Jin XC(金闲驰);  Xu CB(徐晨彪);  Geng ZH(耿振华)
收藏  |  浏览/下载:12/0  |  提交时间:2015/11/13
Fundamental studies of methanol photocatalysis on TiO2(110) 会议论文
2015 gordon research conference (grc) on dynamics at surfaces, 美国, 2015-08-09
作者:  Guo Q(郭庆);  Xu CB(徐晨彪);  Ren ZF(任泽峰);  Yang WS(杨文绍);  Ma ZB(马志博)
收藏  |  浏览/下载:7/0  |  提交时间:2015/11/13
Surface Photocatalysis of Methanol and Water on TiO2 会议论文
2015 gordon research conference (grc) on dynamics at surfaces, 美国, 2015-08-09
作者:  Yang XM(杨学明)
收藏  |  浏览/下载:12/0  |  提交时间:2015/11/13
Localized excitation of Ti3+ ions in the photoabsorption and photocatalytic activity of reduced rutile TiO2 会议论文
2015 gordon research conference (grc) on dynamics at surfaces, 美国, 2015-08-09
作者:  Zhou CY(周传耀);  Wang ZQ(王志强);  Wen B(闻波);  Hao QQ(郝群庆);  Liu LM(刘利民)
收藏  |  浏览/下载:13/0  |  提交时间:2015/11/13
DFT simulations of water adsorption and activation on low index a-Ga2O3 surfaces 会议论文
the 15th international congress of quantum chemistry (icqc), 中国, 2015-06-08
作者:  Zhou X(周新);  EmielJ.M.Hensen;  RutgerA.vanSanten;  Li C(李灿)
收藏  |  浏览/下载:20/0  |  提交时间:2015/11/13
Construction of high dimensional potential energy surfaces using neural networks 会议论文
dicp symposium (xxxvii) on theoretical challenges in small molecule dynamics,a satellite meeting of the 15th international congress of quantum chemistry, 中国, 2015-06-02
作者:  Chen J(陈俊);  Xu X(徐昕);  Zhang DH(张东辉)
收藏  |  浏览/下载:8/0  |  提交时间:2015/11/13


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