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• 大连化学物理研究... [260]

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• OAI收割 [244]
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• 期刊论文 [251]
• 会议论文 [9]

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• 2019 [31]
• 2018 [25]
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• 物理化学 [26]

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浏览/检索结果: 共260条，第1-10条 帮助 限定条件 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     条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择提交时间升序提交时间降序发表日期升序发表日期降序题名升序题名降序作者升序作者降序 Investigation on the excited state intramolecular proton transfer process for the novel 2-(3,5-dichloro-2-hydroxy-phenyl)-benzooxazole-5-carboxylicacid system 期刊论文  OAI收割 JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2019, 卷号: 32, 期号: 10, 页码: 9 作者:  Gao, Haiyan;  Yang, Xiaohui;  Zhang, Tianjie;  Yang, Dapeng   |  收藏  |  浏览/下载：79/0  |  提交时间：2019/12/02 charge density differences  charge redistribution  ESIPT  frontier molecular orbital  intramolecular hydrogen bond   Theoretical insights into elaborating and regulating excited state dynamics for the novel 6-cyano-2-(2 '-hydroxyphenyl)imidazo[1,2a]pyridine system in polar and nonpolar solvents 期刊论文  OAI收割 MOLECULAR PHYSICS, 2019, 页码: 9 作者:  Xu, Lei;  Zhang, Qiaoli;  Zhang, Tianjie;  Yang, Dapeng   |  收藏  |  浏览/下载：80/0  |  提交时间：2019/12/02 Intramolecular hydrogen bond  ESIPT  charge density difference  charge redistribution  solvent polarity   A theoretical study of the ESIPT mechanism of 3-hydroxyflavone derivatives: solvation effect and the importance of TICT for its dual fluorescence properties 期刊论文  OAI收割 ORGANIC CHEMISTRY FRONTIERS, 2019, 卷号: 6, 期号: 17, 页码: 3136-3143 作者:  Qi, Yutai;  Lu, Meiheng;  Wang, Yi;  Tang, Zhe;  Gao, Ziqing   |  收藏  |  浏览/下载：103/0  |  提交时间：2019/12/02 Enhancing single-molecule magnet behaviour through decorating terminal ligands in Dy-2 compounds 期刊论文  OAI收割 DALTON TRANSACTIONS, 2019, 卷号: 48, 期号: 33, 页码: 12622-12631 作者:  Ma, Xiufang;  Chen, Bingbing;  Zhang, Yi-Quan;  Yang, Jinhui;  Shi, Quan   |  收藏  |  浏览/下载：61/0  |  提交时间：2019/12/02 Boosting the rate capability of multichannel porous TiO2 nanofibers with well-dispersed Cu nanodots and Cu2+-doping derived oxygen vacancies for sodium-ion batteries 期刊论文  OAI收割 NANO RESEARCH, 2019, 卷号: 12, 期号: 9, 页码: 2211-2217 作者:  Wu, Ying;  Wei, Zengxi;  Xu, Rui;  Gong, Yue;  Gu, Lin   |  收藏  |  浏览/下载：76/0  |  提交时间：2019/12/02 multichannel porous TiO2 nanofibers  Cu nanodots  Cu2+ doping  sodium ion batteries  density functional theory (DFT) calculations   Carbon Monoxide Activation on Cobalt Carbide for Fischer-Tropsch Synthesis from First-Principles Theory 期刊论文  OAI收割 ACS CATALYSIS, 2019, 卷号: 9, 期号: 9, 页码: 8093-8103 作者:  Chen, Pei-Pei;  Liu, Jin-Xun;  Li, Wei-Xue   |  收藏  |  浏览/下载：86/0  |  提交时间：2019/12/02 CO dissociation  cobalt carbide  phase diagram  DFT calculation  active phase  Fischer-Tropsch synthesis   Self-Supported and Flexible Sulfur Cathode Enabled via Synergistic Confinement for High-Energy-Density Lithium-Sulfur Batteries 期刊论文  OAI收割 ADVANCED MATERIALS, 2019, 卷号: 31, 期号: 33, 页码: 11 作者:  Wang, Zhuosen;  Shen, Jiadong;  Liu, Jun   |  收藏  |  浏览/下载：71/0  |  提交时间：2019/12/02 flexible electrodes  high sulfur loading  Li-S batteries  self-supported arrays  synergistic confinement   Enhanced reactivity of fluorine with para-hydrogen in cold interstellar clouds by resonance-induced quantum tunnelling 期刊论文  OAI收割 NATURE CHEMISTRY, 2019, 卷号: 11, 期号: 8, 页码: 744-749 作者:  Yang, Tiangang   |  收藏  |  浏览/下载：51/0  |  提交时间：2019/12/02 A time-dependent density functional theory study on the excited state behavior of a novel T-2(OH)B molecule 期刊论文  OAI收割 JOURNAL OF THE CHINESE CHEMICAL SOCIETY, 2019, 页码: 8 作者:  Jia, Min;  Song, Xiaoyan;  Yang, Xiaohui;  Yang, Dapeng   |  收藏  |  浏览/下载：56/0  |  提交时间：2019/12/02 charge distribution  ESIPT  intramolecular hydrogen bond  potential energy curve   Insight into the role of Ni-Fe dual sites in the oxygen evolution reaction based on atomically metal-doped polymeric carbon nitride 期刊论文  OAI收割 JOURNAL OF MATERIALS CHEMISTRY A, 2019, 卷号: 7, 期号: 23, 页码: 14001-14010 作者:  Wu, Chuchu;  Zhang, Xiaoming;  Xia, Zhangxun;  Shu, Miao;  Li, Huanqiao   |  收藏  |  浏览/下载：66/0  |  提交时间：2019/12/02