CORC

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CORC

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Approximating dynamic proximity with a hybrid geometry energy-based kernel for diffusion maps 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2019, 卷号: 151, 期号: 10, 页码: 11
作者:  Tan, Qingzhe;  Duan, Mojie;  Li, Minghai;  Han, Li;  Huo, Shuanghong
收藏  |  浏览/下载：56/0  |  提交时间：2020/01/14
Theoretical study on twisted intramolecular charge transfer of 1-aminoanthraquinone in different solvents 期刊论文
CHINESE PHYSICS B, 2018, 卷号: 27, 期号: 8
作者:  Sun, Si-Mei;  Zhang, Song;  Jiang, Chao;  Guo, Xiao-Shan;  Hu, Yi-Hui
收藏  |  浏览/下载：31/0  |  提交时间：2018/11/05
Identifying the effective phosphorous species over modified P-ZSM-5 zeolite: a theoretical study 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2018, 卷号: 20, 期号: 17, 页码: 11702-11712
作者:  Li, Guangchao;  Xu, Guangtong;  Zhang, Xin;  Gao, Xiuzhi;  Chu, Yueying
收藏  |  浏览/下载：25/0  |  提交时间：2018/08/15
theoreticalstudyontwistedintramolecularchargetransferof1aminoanthraquinoneindifferentsolvents 期刊论文
chinesephysicsb, 2018, 卷号: 27, 期号: 8
作者:  Sun Simei;  Zhang Song;  Jiang Chao;  Guo Xiaoshan;  Hu Yihui
收藏  |  浏览/下载：11/0  |  提交时间：2020/01/14
Influences of the confinement effect and acid strength of zeolite on the mechanisms of Methanol-to-Olefins conversion over H-ZSM-5: A theoretical study of alkenes-based cycle 期刊论文
MICROPOROUS AND MESOPOROUS MATERIALS, 2016, 卷号: 231, 页码: 216-229
作者:  Zhang, Wenna;  Chu, Yueying;  Wei, Yingxu;  Yi, Xianfeng;  Xu, Shutao
收藏  |  浏览/下载：26/0  |  提交时间：2016/09/05
Influence of acid strength on the reactivity of alkane activation on solid acid catalysts: A theoretical calculation study 期刊论文
MICROPOROUS AND MESOPOROUS MATERIALS, 2012, 卷号: 151, 页码: 241-249
作者:  Chu, Yueying;  Han, Bing;  Fang, Hanjun;  Zheng, Anmin;  Deng, Feng
收藏  |  浏览/下载：17/0  |  提交时间：2015/06/25
Reaction mechanism for CO oxidation on Cu(3 1 1): A density functional theory study 期刊论文
APPLIED SURFACE SCIENCE, 2012, 卷号: 258, 期号: 8, 页码: 3980-3985
作者:  Liu, Shuping;  Jin, Peng;  Hao, Ce;  Zhang, Donghui;  Yang, Xueming
收藏  |  浏览/下载：13/0  |  提交时间：2015/06/25
DFT studies on the reaction mechanism of cross-metathesis of ethylene and 2-butylene to propylene over heterogeneous Mo/HBeta catalyst 期刊论文
JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL, 2010, 卷号: 330, 期号: 1-2, 页码: 99-106
作者:  Li, Xin;  Guan, Jing;  Zheng, Anmin;  Zhou, Danhong;  Han, Xiuwen
收藏  |  浏览/下载：16/0  |  提交时间：2015/06/25
On the theory of superfluidity 期刊论文
ANNALS OF PHYSICS, 2008, 卷号: 323, 期号: 10, 页码: 2367-2375
作者:  Yu, Yongle
收藏  |  浏览/下载：12/0  |  提交时间：2015/10/13
Theoretical study on the structures, isomerization and stability of SiC3H isomers 期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, 2008, 卷号: 119, 期号: 5-6, 页码: 501-509
作者:  Sun, Hao;  Tan, Nannan;  He, Hongqing;  Pan, Xiumei;  Su, Zhongmin
收藏  |  浏览/下载：18/0  |  提交时间：2015/10/13

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