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兰州理工大学 [8]

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期刊论文 [8]

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限定条件	专题：兰州理工大学第一署名单位第一作者单位通讯作者单位

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	Interstitial doping of K and Mn induced structural distortion and electronic properties changes in all-inorganic CsPbI2Br perovskite 期刊论文 Materials Research Express, 2022, 卷号: 9, 期号: 4 作者: Xue, Hong-Tao; Hu, Zhong-Lin; Luo, Ya-Qiao; An, Jun-Peng; Tang, Fu-Ling 收藏 \| 浏览/下载：30/0 \| 提交时间：2022/06/20 Binary alloys Bromine compounds Calculations Electronic properties Lead compounds Manganese Photovoltaic effects Structural properties CsPbI2br perovskite First principle calculations Inorganics Interstitial doping Interstitials K-doping Mn-doping Octahedral interstices Property changes Structural distortions
	Vacancy defects on optoelectronic properties of double perovskite Cs2AgBiBr6 期刊论文 Materials Science in Semiconductor Processing, 2021, 卷号: 123 作者: Chen, Hong; Zhang, Cai-Rong; Liu, Zi-Jiang; Gong, Ji-Jun; Wang, Wei 收藏 \| 浏览/下载：2/0 \| 提交时间：2021/03/02 Binding energy Bismuth compounds Cesium compounds Crystal atomic structure Defects Density functional theory Electronic structure Energy gap Excitons Light absorption Perovskite Red Shift Silver compounds Absorption capability Double perovskites Exciton-binding energy Low energy regions Optoelectronic properties Slight deformations Supercell model Vacancy effects
	Interface configuration effects on excitation, exciton dissociation, and charge recombination in organic photovoltaic heterojunction 期刊论文 International Journal of Quantum Chemistry, 2020, 卷号: 120, 期号: 4 作者: Bai, Rui-Rong; Zhang, Cai-Rong; Wu, You-Zhi; Yuan, Li-Hua; Zhang, Mei-Ling 收藏 \| 浏览/下载：2/0 \| 提交时间：2020/11/14 Charge transfer Density functional theory Dissociation Electronic structure Excited states Excitons Heterojunctions Morphology Photovoltaic effects Rate constants Charge recombinations Donor-acceptor complex Donor-acceptor heterojunctions Excitation properties Heterojunction interfaces Interface configuration Molecular configurations Organic heterojunctions
	Phase-field modeling and electronic structural analysis of flexoelectric effect at 180° domain walls in ferroelectric PbTiO3 期刊论文 Journal of Applied Physics, 2017, 卷号: 122, 期号: 22 作者: Wang, Yu-Jia; Li, Jiangyu; Zhu, Yin-Lian; Ma, Xiu-Liang 收藏 \| 浏览/下载：14/0 \| 提交时间：2020/11/14 Calculations Electric fields Ferroelectric materials Ferroelectricity Lead titanate Polarization Structural analysis Titanium compounds Electronic charge density Electronic mechanisms First-principles calculation Flexoelectric effects Nano scale Phase field models Phase-field simulation Spontaneous polarizations
	The role of electronic donor moieties in porphyrin dye sensitizers for solar cells: Electronic structures and excitation related properties 期刊论文 JOURNAL OF RENEWABLE AND SUSTAINABLE ENERGY, 2017, 卷号: 9, 期号: 5 作者: Li, Shuai-Hu; Zhang, Cai-Rong; Yuan, Li-Hua; Zhang, Mei-Ling; Chen, Yu-Hong 收藏 \| 浏览/下载：6/0 \| 提交时间：2019/11/15 Blue shift Charge transfer Chromophores Dye-sensitized solar cells Electronic structure Electrons Energy conversion Free energy Molecular orbitals Photons Porphyrins Conjugation effects Conversion process Dye regeneration Electron donor moieties Energy variations Excitation properties Power conversion efficiencies Transferred charges
	Impact of electron delocalization on the nature of the charge-transfer states in model pentacene/C60 Interfaces: A density functional theory study 期刊论文 Journal of Physical Chemistry C, 2014, 卷号: 118, 期号: 48, 页码: 27648-27656 作者: Yang, Bing; Yi, Yuanping; Zhang, Cai-Rong; Aziz, Saadullah G.; Coropceanu, Veaceslav 收藏 \| 浏览/下载：0/0 \| 提交时间：2020/11/14 Charge transfer Heterojunctions Interface states Molecules Photovoltaic effects Charge separation mechanism Density functional theory studies Electron delocalization Electronic delocalization Intermolecular interactions Organic photovoltaic devices Photocurrent generations Time dependent density functional theory
	The role of terminal groups in electronic structures and related properties: The case of push-pull porphyrin dye sensitizers for solar cells 期刊论文 COMPUTATIONAL AND THEORETICAL CHEMISTRY, 2014, 卷号: 1039, 页码: 62-70 作者: Zhang, Cai-Rong; Han, Li-Heng; Zhe, Jian-Wu; Jin, Neng-Zhi; Shen, Yu-Lin 收藏 \| 浏览/下载：10/0 \| 提交时间：2019/11/15 Push-pull porphyrins Dye sensitizers Electronic structures Substitution effects Density functional theory
	Coupling analysis on thermoviscoelastic constitutive of nano-Fe 3O4 reinforced nitrile butadiene rubber 期刊论文 Journal of Thermoplastic Composite Materials, 2012, 卷号: 25, 期号: 3, 页码: 305-318 作者: Wang, Qilei; Yang, Fengyu; Liu, Yi; Yang, Qian; Chen, Junhui 收藏 \| 浏览/下载：12/0 \| 提交时间：2020/11/14 Butadiene Cyanides Fatigue testing Free energy Iron oxides Magnetite Reinforcement Rubber Stress-strain curves Thermal fatigue Thermoelasticity Compressive forces Coupling analysis Electronic temperature Mechanical effects Nitrile butadiene rubber Non equilibrium thermodynamics Split Hopkinson pressure bars Thermo-viscoelastic

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