Zobrazeno 1 - 10
of 16
pro vyhledávání: '"Xing-Liang Peng"'
Publikováno v:
Solar Energy. 224:491-499
Computational study on relationship between molecular structure and property of small molecule hole-transporting materials (HTMs) is an efficient pathway to acquire potential HTMs for perovskite solar cells (PSCs). Herein, by conjugating the acceptor
Autor:
Kailun Bi, Lin Ji, Wei-Lu Ding, Yaqin Zhang, Hongyan He, Xing-Liang Peng, Zhu-Zhu Sun, Yanlei Wang
Publikováno v:
Materials Advances. 2:2009-2020
Ionic liquids (ILs) play an important role in conducting polymer poly(3,4-ethylenedioxythiophene) (PEDOT) based electronics and thermoelectrics through regulating morphology and electronic properties. Herein, the hole transport and interface electron
Publikováno v:
New Journal of Chemistry. 44:15244-15250
In this work, two novel electron-deficient groups phenanthrothiadiazole (PT) and triphenylenobisthiadiazole (TBT) are utilized to construct donor–acceptor–donor (D–A–D) type hole-transporting materials (HTMs). The electronic, optical and char
Publikováno v:
Physical Chemistry Chemical Physics. 22:16359-16367
The design of new molecules with theoretical chemistry methods and further obtaining a fundamental understanding of the structure-property relationship are important for the development of high-efficiency hole-transporting materials (HTMs). Herein, t
Publikováno v:
ChemPhotoChem. 3:814-824
Electronic structure calculations and nonadiabatic dynamics simulations were carried out on the excited state decay mechanism of a typical aggregation-induced emission (AIE)-active molecule, 10,10 ',11,11 '-tetrahydro-5,5 '-bidibenzo[a,d][7]annulenyl
Autor:
Zhu-Zhu Sun, Xing-Liang Peng, Suojiang Zhang, Hongyan He, Chenlu Wang, Wei-Lu Ding, Yaqin Zhang
Publikováno v:
Physical chemistry chemical physics : PCCP. 22(17)
Poly(3,4-ethylenedioxythiophene) (PEDOT) has aroused great interest in organic electrics because of its high electrical conductivity and mechanical flexibility. To improve the charge transport, it can act as an ionic liquid (IL) additive due to its i
Publikováno v:
Physical chemistry chemical physics : PCCP. 22(10)
Multiple absorbers that function in different absorption regions (near infra-red (NIR) and UV-Visible (UV-Vis)) have been widely used in solar cell applications to enhance the light-harvesting. Herein, two special co-sensitizing Models 1 and 2, which
Publikováno v:
Journal of Molecular Graphics and Modelling. 77:322-329
We have theoretically designed two D-A-π-A dyes 3 and 4 based on the efficient references 1 and 2 by introducing an extra electron donor unit (D2). Via calculating the electronic structures of isolated dyes, we obtain that dyes 3 and 4 possess stron
Publikováno v:
Organic Chemistry Frontiers. 4:1153-1161
Upon application of heat or UV light, acyl azides undergo the Curtius rearrangement leading to an isocyanate with the loss of nitrogen gas, which is of great importance in organic chemistry and biological science. The mechanism of the thermal Curtius
Publikováno v:
Journal of Materials Chemistry A. 5:14319-14330
Herein, we theoretically designed and characterized the bifunctional aromatic linker PDTCA utilized in CdSe quantum dot-sensitized solar cells and further modified its benzene ring by varying both its functional groups (NMe2, NH2, OMe, OH, Me, Cl, F,