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兰州理工大学 [23]

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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
	Segregation of alloying elements and their effects on the thermodynamic stability and fracture strength of γ-Ni/γ′-Ni3Al interface 期刊论文 Journal of Materials Science, 2020, 卷号: 55, 期号: 26, 页码: 12513-12524 作者: Ahmed, Fawaz Alnoman Mohammed; Xue, Hong-Tao; Tang, Fu-Ling; An, Jun-Peng; Luo, Ya-Qiao 收藏 \| 浏览/下载：17/0 \| 提交时间：2022/02/17 Alloying Alloying elements Calculations Fracture Fracture toughness Nickel alloys Nickel compounds Phase interfaces Single crystals Stability Superalloys Thermodynamic stability Thermodynamics Bonding strength Densities of state First-principles calculation Interfacial fracture Interfacial segregation Micro mechanisms Microstructural stability Single crystal superalloys
	Segregation of alloying elements and their effects on the thermodynamic stability and fracture strength of γ-Ni/γ′-Ni3Al interface 期刊论文 Journal of Materials Science, 2020, 卷号: 55, 期号: 26, 页码: 12513-12524 作者: Ahmed, Fawaz Alnoman Mohammed; Xue, Hong-Tao; Tang, Fu-Ling; An, Jun-Peng 收藏 \| 浏览/下载：2/0 \| 提交时间：2020/11/14 Alloying Alloying elements Calculations Fracture Fracture toughness Nickel alloys Nickel compounds Phase interfaces Single crystals Stability Superalloys Thermodynamic stability Thermodynamics Bonding strength Densities of state First-principles calculation Interfacial fracture Interfacial segregation Micro mechanisms Microstructural stability Single crystal superalloys
	Effect of Co-Doping on the Stability of γ'-Ni3Al: A First-Principles Study 期刊论文 Xiyou Jinshu Cailiao Yu Gongcheng/Rare Metal Materials and Engineering, 2020, 卷号: 49, 期号: 8, 页码: 2746-2753 作者: Li, Yamin; Chen, Yinping; Liu, Hongjun 收藏 \| 浏览/下载：17/0 \| 提交时间：2020/12/18 Atoms Charge transfer Chemical bonds Density functional theory Electronic density of states Electrons Fermi level Heat treatment Nickel compounds Stability Bonding characteristics Bonding electrons Density difference First-principles density functional theory First-principles study Formation enthalpy Orbital hybridization Plane-wave pseudopotential method
	Effect of Co-Doping on the Stability of gamma '-Ni3Al: A First-Principles Study 期刊论文 RARE METAL MATERIALS AND ENGINEERING, 2020, 卷号: 49, 期号: 8, 页码: 2746-2753 作者: Li Yamin; Chen Yinping; Liu Hongjun 收藏 \| 浏览/下载：12/0 \| 提交时间：2022/03/01 first-principles gamma ' phase electronic structure stability
	Truncated octahedral LiNi0.5Mn1.5O4 with excellent electrochemical properties for lithium-ion batteries prepared by a graphite assisted calcination method 期刊论文 NEW JOURNAL OF CHEMISTRY, 2019, 卷号: 43, 期号: 38, 页码: 15396-15404 作者: Wang, Peng; Li, Hongliang; Wei, Yuan; Zhao, Dongni; Mao, Liping 收藏 \| 浏览/下载：6/0 \| 提交时间：2019/11/15
	Molecular Dynamics Research of Crack Propagation of Single Crystal gamma-TiAl Alloy along the Different Crystalline Phases 期刊论文 RARE METAL MATERIALS AND ENGINEERING, 2017, 卷号: 46, 期号: 12, 页码: 3792-3798 作者: Luo Dechun; Rui Zhiyuan; Fu Rong; Zhang Ling; Cao Hui 收藏 \| 浏览/下载：4/0 \| 提交时间：2019/11/15 gamma-TiAl alloy molecular dynamics crystallographic orientation crack propagation
	Molecular Dynamics Research of Crack Propagation of Single Crystal γ-TiAl Alloy along the Different Crystalline Phases 期刊论文 Xiyou Jinshu Cailiao Yu Gongcheng/Rare Metal Materials and Engineering, 2017, 卷号: 46, 期号: 12, 页码: 3792-3798 作者: Luo, Dechun; Rui, Zhiyuan; Fu, Rong; Zhang, Ling; Cao, Hui 收藏 \| 浏览/下载：13/0 \| 提交时间：2020/11/14 Brittleness Crack propagation Crack tips Dislocations (crystals) Molecular dynamics Molecular orientation Plasticity Single crystals Stress analysis Titanium alloys Crystalline phasis Crystallographic orientations Dislocation emissions Mechanical behavior Molecular dynamics simulations Orientation effect TiAl alloy Uniaxial tensions
	Microstructure and texture evolution of electrodeposited coatings of nickel in the industrial electrolyte 期刊论文 SURFACE & COATINGS TECHNOLOGY, 2017, 卷号: 330, 页码: 170-177 作者: Xu Yang-tao; Dai Yu-jie; Zhang Wei; Xia Tian-dong 收藏 \| 浏览/下载：1/0 \| 提交时间：2019/11/15 Electro-crystallization Nucleation and growth Electrodeposited coatings of nickel Preferential orientation Microstructure
	Linear-scaling density functional simulations of the effect of crystallographic structure on the electronic and optical properties of fullerene solvates 期刊论文 PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2017, 卷号: 19, 期号: 7, 页码: 5617-5628 作者: Xue, Hong-Tao; Boschetto, Gabriele; Krompiec, Michal; Morse, Graham E.; Tang, Fu-Ling 收藏 \| 浏览/下载：15/0 \| 提交时间：2022/03/01

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