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CORC

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When does a functional correctly describe both the structure and the energy of the transition state? 期刊论文
JOURNAL OF MOLECULAR MODELING, 2017, 卷号: 23, 期号: 2
作者:  Su, Neil Qiang;  Pernot, Pascal;  Xu, Xin;  Savin, Andreas
收藏  |  浏览/下载：4/0  |  提交时间：2019/12/05
Theoretical and Experimental Investigation of Terahertz Absorption Spectra for Water Clusters (H2O) (n) (n=4, 5, 6) in the Atmosphere 期刊论文
JOURNAL OF APPLIED SPECTROSCOPY, 2016, 卷号: 83, 期号: 3
作者:  Wu, Y. D.;  Zhou, T.;  Yao, Z. W.;  Cao, J. C.
收藏  |  浏览/下载：3/0  |  提交时间：2019/12/05
Interaction of curcumin with Al(III) and its complex structures based on experiments and theoretical calculations 期刊论文
Journal of Molecular Structure, 2011, 卷号: 1004, 期号: 1月3日
作者:  Jiang, Teng/55332022700[0];  Wang, Long/36674140100[1];  Zhang, Sui/36674345000[2];  Sun, Pingchuan/7202975951[3];  Ding, Chuanfan/7202621936[4]
收藏  |  浏览/下载：4/0  |  提交时间：2019/12/19
Surface reaction mechanism of Y2O3 atomic layer deposition on the hydroxylated Si(100)-2 x 1: A density functional theory study 期刊论文
APPLIED SURFACE SCIENCE, 2009, 卷号: 255, 期号: 16
作者:  Ren, Jie;  Zhou, Guangfen;  Hu, Yongqi;  Zhang, David Wei
收藏  |  浏览/下载：2/0  |  提交时间：2019/12/19
Surface reactions in atomic layer deposition of HfO(2), ZrO(2) and Al(2)O(3) on hydroxylated and sulfur-passivated GaAs(100) surfaces: A comparative study by density functional theory 期刊论文
APPLIED SURFACE SCIENCE, 2008, 卷号: 254, 期号: 22
作者:  Ren, Jie;  Zhou, Guangfen;  Hua, Yongqi;  Jiang, Haichao;  Zhang, David Wei
收藏  |  浏览/下载：2/0  |  提交时间：2019/12/19
Initial surface reactions in atomic layer deposition of HfSixOy and HfO2: A comparative study by density functional theory 期刊论文
THIN SOLID FILMS, 2008, 卷号: 516, 期号: 10
作者:  Ren, Jie;  Hu, Yongqi;  Wang, Jianying;  Jiang, Haichao;  Zhang, David Wei
收藏  |  浏览/下载：4/0  |  提交时间：2019/12/19
Study on the mechanism of water absorption of SiOC low-k dielectrics 期刊论文
Shanghai Jiaotong Daxue Xuebao/Journal of Shanghai Jiaotong University, 2007, 卷号: 41
作者:  Sun, Liang/56945779400[0];  Zhu, Lian/55231539300[1];  Xue, Yuan/55222747700[2];  Ding, Shijin/36818159500[3];  Zhang, Wei/36066941200[4]
收藏  |  浏览/下载：2/0  |  提交时间：2019/12/27

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