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Insights into the inhibition mechanism of a novel supramolecular complex towards the corrosion of mild steel in the condensate water: experimental and theoretical studies 期刊论文
RESEARCH ON CHEMICAL INTERMEDIATES, 2018, 卷号: 44, 期号: 10, 页码: 5711-5736
作者:  Fan, Baomin;  Hao, Hua;  Yang, Biao;  Li, Yun
收藏  |  浏览/下载:14/0  |  提交时间:2019/04/09
Investigation of electronic structure and optical properties of thallium lead halides: First principle calculations 期刊论文
JOURNAL OF APPLIED PHYSICS, 2018, 卷号: 124, 期号: 9
作者:  Mahmood, Asad;  Shi, Gansehng;  Sun, Jing;  Liu, Jianjun
收藏  |  浏览/下载:18/0  |  提交时间:2018/12/28
Computational research of Nin+1, Aln+1, AlnNi, AlnNi2 (n=1-7) clusters by density functional theory 期刊论文
COMPUTATIONAL AND THEORETICAL CHEMISTRY, 2016, 卷号: 1088, 页码: 44-51
作者:  Wen, Jun-Qing;  Zhang, Jian-Min;  Chen, Guo-Xiang;  Mang, Cheng-Ju;  Wen, Zhen-Yi
收藏  |  浏览/下载:19/0  |  提交时间:2018/05/31
Crystal structures and mechanical properties of M (Mg, Sr, Ba, La)(x)Ca1-xB6 solid solution: A first principles study 期刊论文
CERAMICS INTERNATIONAL, 2016, 卷号: 42, 期号: 6, 页码: 6632-6639
作者:  He, Jian;  Luo, Kan;  Qiao, Yingjie;  He, Shihong;  Zha, Xian-Hu
收藏  |  浏览/下载:18/0  |  提交时间:2019/06/20
Quantum Chemical Study of Geometric Structures and Properties for AgnH2S (n=1 similar to 10) Clusters 期刊论文
CHINESE JOURNAL OF STRUCTURAL CHEMISTRY, 2015, 卷号: 34, 页码: 1487-1495
作者:  Wen Jun-Qing;  Xu Wei-Feng;  Liu Ke-Yang;  Chen Guo-Xiang;  Wen Zhen-Yi
收藏  |  浏览/下载:9/0  |  提交时间:2018/05/31
Theoretical studies of three triazole derivatives as corrosion inhibitors for mild steel in acidic medium 期刊论文
CORROSION SCIENCE, 2014, 卷号: 87, 页码: 366-375
作者:  Guo, Lei;  Zhu, Shanhong;  Zhang, Shengtao;  He, Qiao;  Li, Weihua
收藏  |  浏览/下载:22/0  |  提交时间:2015/06/11
Dynamics of Triplet-State Photochemistry of Pentanal: Mechanisms of Norrish I, Norrish II, and H Abstraction Reactions 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2013, 卷号: 117, 期号: 46, 页码: 11711-11724
作者:  Shemesh, Dorit;  Lan, Zhenggang;  Gerber, R. Benny
收藏  |  浏览/下载:19/0  |  提交时间:2014/03/21
Binding Free Energy Estimation for Protein-Ligand Complex Based on MM-PBSA with Various Partial Charge Models 期刊论文
current pharmaceutical design, 2013, 卷号: 19, 期号: 12, 页码: 2293-2307
作者:  Fu, Ting;  Jin, Zhong;  Xiu, Zhilong;  Li, Guohui
收藏  |  浏览/下载:13/0  |  提交时间:2015/11/09
Magnetic and electronic structural properties of the GdGa7N 8 cluster 会议论文
8th International Conference on Thin Film Physics and Applications, TFPA 2013, Shanghai, China, September 20, 2013 - September 23, 2013
作者:  Fang, Yanbian;  Zhou, Bofan;  Huang, Yan;  Zeng, Yijie;  Lu, Aijiang
收藏  |  浏览/下载:2/0  |  提交时间:2017/01/20


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