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• 大连化学物理研究... [113]

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• OAI收割 [108]
• iSwitch采集 [5]

内容类型

• 期刊论文 [113]

发表日期

• 2019 [11]
• 2018 [7]
• 2017 [7]
• 2016 [3]
• 2015 [2]
• 2014 [10]
• 更多

学科主题

• 物理化学 [16]

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浏览/检索结果: 共113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题名升序题名降序作者升序作者降序发表日期升序发表日期降序 Tuning electronic and optical properties of CsPbI3 by applying strain: A first-principles theoretical study 期刊论文  OAI收割 CHEMICAL PHYSICS LETTERS, 2019, 卷号: 732, 页码: 4 作者:  Jing, Huijuan;  Sa, Rongjian;  Xu, Ge   |  收藏  |  浏览/下载：87/0  |  提交时间：2019/12/02 Hydrostatic strain  CsPbI3  Electronic properties  Mechanical properties  First-principles calculations   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：77/0  |  提交时间：2019/12/02 multichannel porous TiO2 nanofibers  Cu nanodots  Cu2+ doping  sodium ion batteries  density functional theory (DFT) calculations   Encapsulating a Ni(II) molecular catalyst in photoactive metal-organic framework for highly efficient photoreduction of CO2 期刊论文  OAI收割 SCIENCE BULLETIN, 2019, 卷号: 64, 期号: 14, 页码: 976-985 作者:  Yan, Zhi-Hao;  Ma, Bo;  Li, Shu-Rong;  Liu, Junxue;  Chen, Rong   |  收藏  |  浏览/下载：112/0  |  提交时间：2019/12/02 Metal-organic frameworks  CO2 reduction  Transient absorption  Photocatalysis  DFT calculations   Mechanistic Understanding of Size-Dependent Oxygen Reduction Activity and Selectivity over Pt/CNT Nanocatalysts 期刊论文  OAI收割 EUROPEAN JOURNAL OF INORGANIC CHEMISTRY, 2019, 期号: 27, 页码: 3210-3217 作者:  Gan, Jie;  Luo, Wei;  Chen, Wenyao;  Guo, Jianing;  Xiang, Zhonghua   |  收藏  |  浏览/下载：53/0  |  提交时间：2019/12/02 Sustainable chemistry  Catalysis  Platinum  Active site  Density functional calculations   Oxygen vacancy mediated La1-xCexFeO3-delta perovskite oxides as efficient catalysts for CWAO of acrylic acid by A-site Ce doping 期刊论文  OAI收割 APPLIED CATALYSIS B-ENVIRONMENTAL, 2019, 卷号: 245, 页码: 20-28 作者:  Sun, Wenjing;  Wei, Huangzhao;  An, Lu Yang;  Jin, Chengyu;  Wu, Huiling   |  收藏  |  浏览/下载：60/0  |  提交时间：2019/06/25 Catalytic wet air oxidation  La1-xCexFeO3-delta  Synergistic mechanism  Generalized kinetic model  First-principles calculations   Interplay Between Site Activity and Density of BCC Iron for Ammonia Synthesis Based on First-Principles Theory 期刊论文  OAI收割 CHEMCATCHEM, 2019, 卷号: 11, 期号: 7, 页码: 1928-1934 作者:  Zhang, Bing-Yan;  Su, Hai-Yan;  Liu, Jin-Xun;  Li, Wei-Xue   |  收藏  |  浏览/下载：38/0  |  提交时间：2019/06/20 Heterogeneous Catalysis  Density Functional Calculations  Iron  Kinetics  Ammonia synthesis   Structural Evolution and Electronic Properties of Au2Gen-/0 (n=1-8) Clusters: Anion Photoelectron Spectroscopy and Theoretical Calculations 期刊论文  OAI收割 CHINESE JOURNAL OF CHEMICAL PHYSICS, 2019, 卷号: 32, 期号: 2, 页码: 229-240 作者:  Lu, Sheng-Jie;  Farooq, Umar;  Xu, Hong-Guang;  Xu, Xi-Ling;  Zheng, Wei-Jun   |  收藏  |  浏览/下载：81/0  |  提交时间：2019/06/25 Photoelectron spectroscopy  Transition metal  Germanium cluster  Structural evolution  Quantum chemical calculations   Synthesis of Pure Silica MWW Zeolite in Fluoride Medium by Using an Imidazolium-Based Long Dication 期刊论文  OAI收割 CHEMISTRY-A EUROPEAN JOURNAL, 2019, 卷号: 25, 期号: 6, 页码: 1561-1572 作者:  Gomez-Hortiguela, Luis;  Lu, Peng;  Camblor, Miguel A.   |  收藏  |  浏览/下载：49/0  |  提交时间：2019/06/20 density functional calculations  fluoride media  molecular mechanics  structure directing agent  zeolites   Synthesis of pure silica mww zeolite in fluoride medium by using an imidazolium-based long dication 期刊论文  iSwitch采集 Chemistry-a european journal, 2019, 卷号: 25, 期号: 6, 页码: 1561-1572 作者:  Lu, Peng;  Gomez-Hortiguela, Luis;  Camblor, Miguel A. 收藏  |  浏览/下载：140/0  |  提交时间：2019/05/08 Density functional calculations  Fluoride media  Molecular mechanics  Structure directing agent  Zeolites   Understanding Regioselectivities of Corey-Chaykovsky Reactions of Dimethylsulfoxonium Methylide (DMSOM) and Dimethylsulfonium Methylide (DMSM) toward Enones: A DFT Study 期刊论文  OAI收割 EUROPEAN JOURNAL OF ORGANIC CHEMISTRY, 2019, 期号: 2-3, 页码: 582-590 作者:  Fan, Xing;  Yu, Zhi-Xiang;  Xiang, Yu;  Cai, Pei-Jun   |  收藏  |  浏览/下载：36/0  |  提交时间：2019/06/20 Corey-Chaykovsky Reaction  Cyclopropanation  Epoxidation  DFT calculations  Regioselectivity