QQ客服 官方微博 反馈留言

浏览/检索结果: 共104条，第1-10条 帮助 限定条件 发表日期：2017    内容类型：期刊论文    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 Structural and magnetic properties of FeGen-/0 (n=3-12) clusters: Mass-selected anion photoelectron spectroscopy and density functional theory calculations 期刊论文 JOURNAL OF CHEMICAL PHYSICS, 2017, 卷号: 147, 期号: 23 作者:  Deng, Xiao-Jiao;  Kong, Xiang-Yu;  Liang, Xiaoqing;  Yang, Bin;  Xu, Hong-Guang 收藏  |  浏览/下载：30/0  |  提交时间：2019/06/20 Structural and Electronic Properties of ConC3-/0 and ConC4-/0(n=1-4) Clusters: Mass-Selected Anion Photoelectron Spectroscopy and Density Functional Theory Calculations 期刊论文 CHINESE JOURNAL OF CHEMICAL PHYSICS, 2017, 卷号: 30, 期号: 6, 页码: 717-726 作者:  Xu, Xi-ling;  Yuan, Jin-yun;  Yang, Bin;  Xu, Hong-guang;  Zheng, Wei-jun 收藏  |  浏览/下载：68/0  |  提交时间：2019/06/20 Photoelectron Spectroscopy  Transition Metal Carbide  Structural Evolution  Density Functional Calculations   A DFT/TDDFT Investigation of Excited State Dynamical Mechanism of (E)-1-((2,2-Diphenylhydrazono)methyl)naphthalen-2-ol 期刊论文 JOURNAL OF THE CHINESE CHEMICAL SOCIETY, 2017, 卷号: 64, 期号: 12, 页码: 1385-1391 作者:  Yang, Dapeng;  Wu, Jingyuan;  Jia, Min;  Song, Xiaoyan 收藏  |  浏览/下载：16/0  |  提交时间：2019/06/20 Electronic Spectra  Frontier Molecular Orbitals  Excited-state Intramolecular Proton Transfer  Potential Energy Surface   Theoretical investigation on ESIPT mechanism for a novel Sal-3,4-benzophen system 期刊论文 JOURNAL OF THEORETICAL & COMPUTATIONAL CHEMISTRY, 2017, 卷号: 16, 期号: 8 作者:  Lv, Jian;  Yang, Dapeng 收藏  |  浏览/下载：20/0  |  提交时间：2019/06/20 Hydrogen Bond  Esipt  Electronic Spectra  Potential Energy Curve   An analogy study on ESIPT reaction for 3BHC sensor between polar DMF and nonpolar toluene 期刊论文 CANADIAN JOURNAL OF CHEMISTRY, 2017, 卷号: 95, 期号: 12, 页码: 1303-1307 作者:  Song, Xiaoyan;  Yang, Dapeng;  Jia, Min;  Wu, Jingyuan;  Zhang, Qiaoli 收藏  |  浏览/下载：16/0  |  提交时间：2017/12/19 hydrogen bond  ESIPT  potential energy curves   An analogy study on ESIPT reaction for 3BHC sensor between polar DMF and nonpolar toluene 期刊论文 CANADIAN JOURNAL OF CHEMISTRY, 2017, 卷号: 95, 期号: 12, 页码: 1303-1307 作者:  Wu, Jingyuan;  Zhang, Qiaoli;  Song, Xiaoyan;  Jia, Min;  Yang, Dapeng 收藏  |  浏览/下载：14/0  |  提交时间：2017/12/19 hydrogen bond  ESIPT  potential energy curves   Nonconventional Hydrogen Bonds between Silver Anion and Nucleobases: Size-Selected Anion Photoelectron Spectroscopy and Density Functional Calculations 期刊论文 JOURNAL OF PHYSICAL CHEMISTRY A, 2017, 卷号: 121, 期号: 46, 页码: 8973-8981 作者:  Wang, Peng;  Xu, Hong-Guang;  Cao, Guo-Jin;  Zhang, Wen-Jing;  Xu, Xi-Ling 收藏  |  浏览/下载：11/0  |  提交时间：2019/06/20 Theoretical Investigation of an Excited-State Intramolecular Proton-Transfer Mechanism for an Asymmetric Structure of 3,7-Dihydroxy-4-oxo-2-phenyl-4H-chromene-8-carbaldehyde: Single or Double? 期刊论文 JOURNAL OF PHYSICAL CHEMISTRY A, 2017, 卷号: 121, 期号: 46, 页码: 8807-8814 作者:  Yang, Yi;  Dong, Liang;  Tang, Zhe;  Wang, Yi;  Bao, Dongshuai 收藏  |  浏览/下载：22/0  |  提交时间：2019/06/20 Cooperative N-H and CH2 Skeleton Effects on the Catalytic Activities of Bimetallic Ru(II)-NNN Complexes: Experimental and Theoretical Study 期刊论文 ORGANOMETALLICS, 2017, 卷号: 36, 期号: 21, 页码: 4268-4277 作者:  Zheng, Daoyuan;  Chai, Huining;  Liu, Tingting;  Yu, Zhengkun 收藏  |  浏览/下载：16/0  |  提交时间：2017/12/19 Cooperative N-H and CH2 Skeleton Effects on the Catalytic Activities of Bimetallic Ru(II)-NNN Complexes: Experimental and Theoretical Study 期刊论文 ORGANOMETALLICS, 2017, 卷号: 36, 期号: 21, 页码: 4268-4277 作者:  Zheng, Daoyuan;  Yu, Zhengkun;  Liu, Tingting;  Chai, Huining 收藏  |  浏览/下载：17/0  |  提交时间：2017/12/19