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浏览/检索结果: 共29条，第1-10条 帮助 限定条件 发表日期：2018    专题：大连化学物理研究所    第一署名单位    第一作者单位    通讯作者单位     已选(0)清除 条数/页：5101520253035404550556065707580859095100   排序方式：请选择作者升序作者降序题名升序题名降序发表日期升序发表日期降序提交时间升序提交时间降序 Photoelectron Spectroscopy and Theoretical Study of CrnSi15-n- (n=1-3): Effects of Doping Cr Atoms on the Structural and Magnetic Properties 期刊论文 JOURNAL OF PHYSICAL CHEMISTRY A, 2018, 卷号: 122, 期号: 51, 页码: 9886-9893 作者:  Yang, Bin;  Xu, Xiling;  Zheng, Weijun;  Xu, Hongguang 收藏  |  浏览/下载：36/0  |  提交时间：2019/06/20 Photoelectron spectroscopy and theoretical study of crnsi15-n- (n=1-3): effects of doping cr atoms on the structural and magnetic properties 期刊论文 Journal of physical chemistry a, 2018, 卷号: 122, 期号: 51, 页码: 9886-9893 作者:  Yang, Bin;  Xu, Hongguang;  Xu, Xiling;  Zheng, Weijun 收藏  |  浏览/下载：49/0  |  提交时间：2019/05/08 Reaction Mechanisms of Well-Defined Metal-N-4 Sites in Electrocatalytic CO2 Reduction 期刊论文 ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2018, 卷号: 57, 期号: 50, 页码: 16339-16342 作者:  Zhang, Zheng;  Xiao, Jianping;  Chen, Xue-Jiao;  Yu, Song;  Yu, Liang 收藏  |  浏览/下载：51/0  |  提交时间：2019/06/20 cobalt  density-functional calculations  electrochemistry  reaction mechanisms  reduction   Reaction mechanisms of well-defined metal-n-4 sites in electrocatalytic co2 reduction 期刊论文 Angewandte chemie-international edition, 2018, 卷号: 57, 期号: 50, 页码: 16339-16342 作者:  Zhang, Zheng;  Xiao, Jianping;  Chen, Xue-Jiao;  Yu, Song;  Yu, Liang 收藏  |  浏览/下载：75/0  |  提交时间：2019/05/08 Cobalt  Density-functional calculations  Electrochemistry  Reaction mechanisms  Reduction   Why the lowest electronic excitations of rhodamines are overestimated by time-dependent density functional theory 期刊论文 INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2018, 卷号: 118, 期号: 23, 页码: 11 作者:  Zhou, Panwang 收藏  |  浏览/下载：24/0  |  提交时间：2019/06/20 ADC(2)  cyanine dyes  rhodamine dyes  TDDFT  XMCQDPT2   Why the lowest electronic excitations of rhodamines are overestimated by time-dependent density functional theory 期刊论文 International journal of quantum chemistry, 2018, 卷号: 118, 期号: 23, 页码: 11 作者:  Zhou, Panwang 收藏  |  浏览/下载：40/0  |  提交时间：2019/05/08 Adc(2)  Cyanine dyes  Rhodamine dyes  Tddft  Xmcqdpt2   Methanol to Olefins Reaction over Cavity-type Zeolite: Cavity Controls the Critical Intermediates and Product Selectivity 期刊论文 ACS CATALYSIS, 2018, 卷号: 8, 期号: 12, 页码: 10950-10963 作者:  Zhi, Yuchun;  Wei, Yingxu;  Deng, Feng;  Zhang, Wenna;  Chen, Jingrun 收藏  |  浏览/下载：79/0  |  提交时间：2019/06/20 methanol to olefins  H-RUB-SO  critical intermediates  product selectivity  host guest interaction  cavity-control   Vapor-fumigation for record efficiency two-dimensional perovskite solar cells with superior stability 期刊论文 ENERGY & ENVIRONMENTAL SCIENCE, 2018, 卷号: 11, 期号: 12, 页码: 3349-3357 作者:  Yang, Dong;  Zhao, Kui;  Zhang, Jian;  Liu, Hairui;  Priya, Shashank 收藏  |  浏览/下载：64/0  |  提交时间：2019/06/20 Theoretical study of charge-transport and optical properties of indeno[1,2-b] fluorene-6,12-dione-based semiconducting materials 期刊论文 ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE CRYSTAL ENGINEERING AND MATERIALS, 2018, 卷号: 74, 页码: 705-711 作者:  Cheng, Shi-Bo;  Huang, Jin-Dou;  Zhao, Jinfeng;  Yu, Kun;  Huang, Xiaohua 收藏  |  浏览/下载：37/0  |  提交时间：2019/06/20 indeno[1,2-b] fluorene-6,12-dione-based molecules  intrinsic hole mobility  intrinsic electron mobility  electronic spectra  density functional theory (DFT)  structure-function relationship   Methanol to olefins reaction over cavity-type zeolite: cavity controls the critical intermediates and product selectivity 期刊论文 Acs catalysis, 2018, 卷号: 8, 期号: 12, 页码: 10950-10963 作者:  Zhang, Wenna;  Chen, Jingrun;  Xu, Shutao;  Chu, Yueying;  Wei, Yingxu 收藏  |  浏览/下载：89/0  |  提交时间：2019/05/08 Methanol to olefins  H-rub-so  Critical intermediates  Product selectivity  Host guest interaction  Cavity-control