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CORC

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Structure effect on transition mechanism of UV-visible absorption spectrum in polyimides: A density functional theory study 期刊论文
POLYMER, 2018, 卷号: 148, 页码: 356-369
作者:  Ma, YP;  Hu, CC;  Guo, HX;  Fan, L;  Yang, SY
收藏  |  浏览/下载：22/0  |  提交时间：2019/04/08
Triarylamines with branched multi-pyridine groups: modulation of emission properties by structural variation, solvents, and tris(pentafluorophenyl)borane 期刊论文
SCIENCE CHINA-CHEMISTRY, 2018, 卷号: 61, 期号: 5, 页码: 545-556
作者:  Li, Rui;  Gong, Zhong-Liang;  Tang, Jian-Hong;  Sun, Meng-Jia;  Shao, Jiang-Yang
收藏  |  浏览/下载：140/0  |  提交时间：2019/04/09
Effect of electron-withdrawing terminal group on BDT-based donor materials for organic solar cells: a theoretical investigation 期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, 2018, 卷号: 137, 期号: 5, 页码: 1-11
作者:  Fu, Lu-Lu;  Geng, Hua;  Wang, Guo;  Duan, Yu-Ai;  Geng, Yun
收藏  |  浏览/下载：26/0  |  提交时间：2019/04/09
Synthesis and Characterization of Tris(bidentate) Ruthenium Complexes of Di(pyrid-2-yl)(methyl)amine 期刊论文
EUROPEAN JOURNAL OF INORGANIC CHEMISTRY, 2017, 期号: 24, 页码: 3064-3071
作者:  Wu, Si-Hai;  Shao, Jiang-Yang;  Dai, Xiaojuan;  Cui, Xiuling;  Su, Hongmei
收藏  |  浏览/下载：31/0  |  提交时间：2018/04/19
Evaluating Electronic Couplings for Excited State Charge Transfer Based on Maximum Occupation Method Delta SCF Quasi-Adiabatic States 期刊论文
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2017, 卷号: 13, 期号: 2, 页码: 843-851
作者:  Liu, Junzi;  Zhang, Yong;  Bao, Peng;  Yi, Yuanping
收藏  |  浏览/下载：14/0  |  提交时间：2018/01/12
The nature of excited states in dipolar donor/fullerene complexes for organic solar cells: evolution with the donor stack size 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2016, 卷号: 18, 期号: 23, 页码: 15955-15963
作者:  Shen, Xingxing;  Han, Guangchao;  Yi, Yuanping
收藏  |  浏览/下载：17/0  |  提交时间：2017/01/17
Methane Activation Mediated by a Series of Cerium-Vanadium Bimetallic Oxide Cluster Cations: Tuning Reactivity by Doping 期刊论文
CHEMPHYSCHEM, 2016, 卷号: 17, 期号: 8, 页码: 1112-1118
作者:  Ma, Jia-Bi;  Meng, Jing-Heng;  He, Sheng-Gui
收藏  |  浏览/下载：9/0  |  提交时间：2017/01/23
P3HT:DiPBI bulk heterojunction solar cells: morphology and electronic structure probed by multiscale simulation and UV/vis spectroscopy 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2016, 卷号: 18, 期号: 8, 页码: 6217-6227
作者:  Winands, Thorsten;  Boeckmann, Marcus;  Schemme, Thomas;  Phong-Minh Timmy Ly;  de Jong, Djurre H.
收藏  |  浏览/下载：16/0  |  提交时间：2017/01/23
8-(4-aminophenyl) BODIPYs as fluorescent pH probes: facile synthesis, computational study and lysosome imaging 期刊论文
CHEMISTRYSELECT, 2016, 卷号: 1, 期号: 1, 页码: 1-6
作者:  Zhang, Yuan;  Fang, Hong-mei;  Zhang, Xiao-tai;  Wang, Shu;  Xing, Guo-wen
收藏  |  浏览/下载：22/0  |  提交时间：2018/01/10
Theoretical study on the photodegradation reaction of deca-BDE in THF in the presence of furan 期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, 2015, 卷号: 135, 期号: 1
作者:  Pan, Lu;  Zhang, Jiaxu;  Bian, Wensheng
收藏  |  浏览/下载：134/0  |  提交时间：2016/02/01

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