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Theoretical and experimental investigations about the role of MXene nanosheets covered with ZnO quantum dots on barrier resistance of epoxy coatings 期刊论文
JOURNAL OF ENVIRONMENTAL CHEMICAL ENGINEERING, 2024, 卷号: 12, 期号: 1, 页码: 15
作者:  Pourhashem, Sepideh;  Seif, Abdolvahab;  Zhou, Ziyang;  Ji, Xiaohong;  Sgroi, Mauro Francesco;  Duan, Jizhou;  Rashidi, Alimorad;  Ci, Xiaojing;  Lu, Hao;  Mirzaee, Majid;  Wang, Lifei;  Hou, Baorong
收藏  |  浏览/下载：1/0  |  提交时间：2024/04/07
Hybrid of MXene@ZnO QDs  Silane functionalization  Epoxy coating  Corrosion resistance  DFT studies  
Investigation of triazole derivatives as corrosion inhibitors on Q235 steel in NaCl solution: Experimental and theoretical studies 期刊论文
COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS, 2023, 卷号: 674, 页码: 14
作者:  Lu, Hao;  Ji, Xiaohong;  Ci, Xiaojing;  Zhu, Haoyuan;  Wang, Qingfu;  Zong, Yingxia;  Tian, Huiwen
Adobe PDF(12114Kb)  |  收藏  |  浏览/下载：51/0  |  提交时间：2023/12/13
Q235 steel  Corrosion inhibitors  Triazole derivatives  DFT  
S vacancy in MoS2 nanosheets induces H2O cleavage: a new era for 2D nanozyme 期刊论文
RESEARCH ON CHEMICAL INTERMEDIATES, 2023, 卷号: 49, 期号: 12, 页码: 10
作者:  Wang, Jin;  Ren, Wenyu;  Wang, Yi;  Zhang, Dun;  Wang, Yu;  Ju, Peng;  Dou, Kunpeng
收藏  |  浏览/下载：89/0  |  提交时间：2023/11/30
MoS2  Nanozyme  Peroxidase-like activity  S vacancy  DFT calculations  
Design, Synthesis, and Antifungal Activities of Hymexazol Glycosides Based on a Biomimetic Strategy 期刊论文
JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY, 2022, 页码: 16
作者:  Gao, Kun;  Qin, Yukun;  Wang, Linsong;  Li, Xin;  Liu, Song;  Xing, Ronge;  Yu, HuaHua;  Chen, Xiaolin;  Li, Pengcheng
收藏  |  浏览/下载：181/0  |  提交时间：2022/11/11
hymexazol  glycosylation  antifungal  DFT  proteomics  
Experimental and DFT studies on corrosion protection performance of epoxy/graphene quantum dots@TiO2 nanotubes coatings 期刊论文
CONSTRUCTION AND BUILDING MATERIALS, 2022, 卷号: 322, 页码: 13
作者:  Ji, Xiaohong;  Seif, Abdolvahab;  Duan, Jizhou;  Rashidi, Alimorad;  Zhou, Ziyang;  Pourhashem, Sepideh;  Mirzaee, Majid;  Zhai, Xiaofan;  Zhao, Xia;  Hou, Baorong
Adobe PDF(17977Kb)  |  收藏  |  浏览/下载：203/0  |  提交时间：2022/04/12
GQD@TNT nanohybrids  Silane modification  Long-term corrosion resistance  Epoxy coating  DFT study  
DFT and Raman study of all-trans astaxanthin optical isomers 期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2021, 卷号: 262, 页码: 8
作者:  Yao, Guohua;  Guo, Shuju;  Yu, Wenjie;  Muhammad, Muhammad;  Liu, Jianguo;  Huang, Qing
Adobe PDF(1148Kb)  |  收藏  |  浏览/下载：207/0  |  提交时间：2021/09/18
All-trans astaxanthin  Optical isomers  Raman spectroscopy  DFT  Chiral  
First-principle calculation of the electronic structures and optical properties of the metallic and nonmetallic elements-doped ZnO on the basis of photocatalysis 期刊论文
PHYSICA B-CONDENSED MATTER, 2019, 卷号: 555, 页码: 53-60
作者:  Feng, Chang;  Chen, Zhuoyuan;  Li, Weibing;  Zhang, Fan;  Li, Xiangbo;  Xu, Likun;  Sun, Mingxian
Adobe PDF(1084Kb)  |  收藏  |  浏览/下载：304/0  |  提交时间：2019/08/28
Density functional theory (DFT)  First principle calculation  Doped ZnO  Photocatalysis  
Heterometallic copper(II) vanadates: synthesis, crystal structures and third-order nonlinear optical properties 期刊论文
SCIENCE CHINA-CHEMISTRY, 2014, 卷号: 57, 期号: 9, 页码: 1235-1245
作者:  Liu FaQian;  Wang Lei;  Guo JiXi;  Li WeiHua;  Li ChaoQin;  Jin YanLing;  Li RongXun;  Jian FangFang;  Liu, FQ (reprint author), Qingdao Univ Sci & Technol, Engn Res Ctr High Performance Polymer Molding Tec, Minist Educ, Qingdao 266042, Peoples R China.
Adobe PDF(1820Kb)  |  收藏  |  浏览/下载：255/0  |  提交时间：2015/06/11
Cluster Polymers  Third-order Nonlinear Optical Properties  Td-dft Calculations  Polyoxovanadate  
A New Copper(I) Complex Based on Imidazole and Triphenylphosphine Ligands: Synthesis, Structure, Third-Order NLO, and Fluorescence Properties 期刊论文
CHINESE JOURNAL OF CHEMISTRY, 2012, 卷号: 30, 期号: 5, 页码: 1069-1074
作者:  Liu Faqian;  Jin Yanling;  Liu Baocheng;  Li Rongxun;  Deng Yueyi;  Li Weihua;  Jian Fangfang;  Liu, FQ (reprint author), Qingdao Univ Sci & Technol, Minist Educ, Engn Res Ctr High Performance Polymer & Molding T, Qingdao 266042, Shandong, Peoples R China.
Adobe PDF(1386Kb)  |  收藏  |  浏览/下载：222/0  |  提交时间：2013/09/24
Third-order Nlo Properties  Luminescence  Td-dft  Copper(i) Complex  
Aminic nitrogen-bearing polydentate Schiff base compounds as corrosion inhibitors for iron in acidic media: A quantum chemical calculation 期刊论文
CORROSION SCIENCE, 2008, 卷号: 50, 期号: 3, 页码: 865-871
作者:  Ju, Hong;  Kai, Zhen-Peng;  Li, Yan
Adobe PDF(672Kb)  |  收藏  |  浏览/下载：229/0  |  提交时间：2010/12/24
Corrosion Inhibitor  Quantum Chemical  Dft Method  Schiff Base Compounds  Molecular Orbital