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兰州理工大学 [25]

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期刊论文 [25]

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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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	Coherent and incoherent effects of nanopores on thermal conductance in silicene 期刊论文 International Journal of Thermal Sciences, 2021, 卷号: 167 作者: Cui, Liu; Wei, Gaosheng; Li, Zhao; Ma, Jingjian; Du, Xiaoze 收藏 \| 浏览/下载：8/0 \| 提交时间：2021/06/03 Calculations Coherent scattering Heat conduction Metamaterials Molecular dynamics Nanopores Phonons Silicene Thermal conductivity % reductions Artificial periodicity First principles Nanomesh New approaches Optical phonons Phonon bandgap Silicene Thermal Thermal conductance
	Thermal Transport in Graphene Nanomesh: Unraveling the Role of Brillouin Zone Folding, Phonon Localization and Phonon Confinement 期刊论文 INTERNATIONAL JOURNAL OF HEAT AND MASS TRANSFER, 2021, 卷号: 165, 页码: - 作者: Cui, Liu; Wei, Gaosheng; Li, Zhao; Du, Xiaoze 收藏 \| 浏览/下载：3/0 \| 提交时间：2021/03/12 Calculations Graphene Heat conduction Molecular dynamics Phonons Thermal insulation First-principles calculation Insulation applications Molecular dynamics simulations Optical phonon modes Phonon confinement Phonon dispersions Phonon localization Reduction of thermal conductivity
	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
	Cluster expansion Monte Carlo study of indium-aluminum segregation and homogenization in CuInSe2-CuAlSe2pseudobinary alloys 期刊论文 Physical Chemistry Chemical Physics, 2020, 卷号: 22, 期号: 26, 页码: 14694-14703 作者: Xue, Hong-Tao; Yu, Xu-Dong; Aarons, Jolyon; Tang, Fu-Ling; Lu, Xue-Feng 收藏 \| 浏览/下载：3/0 \| 提交时间：2020/11/14 Atoms Binary alloys Calculations Copper alloys Indium Indium alloys Monte Carlo methods Solar energy Boltzmann function Cluster morphology First-principles calculation Formation energies Homogeneous phase Phase segregations Temperature increase Temperature range
	Cluster expansion Monte Carlo study of indium-aluminum segregation and homogenization in CuInSe2-CuAlSe2pseudobinary alloys 期刊论文 Physical Chemistry Chemical Physics, 2020, 卷号: 22, 期号: 26, 页码: 14694-14703 作者: Xue, Hong-Tao; Yu, Xu-Dong; Aarons, Jolyon; Tang, Fu-Ling; Lu, Xue-Feng 收藏 \| 浏览/下载：17/0 \| 提交时间：2022/02/17 Atoms Binary alloys Calculations Copper alloys Indium Indium alloys Monte Carlo methods Solar energy Boltzmann function Cluster morphology First-principles calculation Formation energies Homogeneous phase Phase segregations Temperature increase Temperature range
	Methane Adsorption Properties of Mn-Modified Graphene: A First-Principles Study 期刊论文 ADVANCED THEORY AND SIMULATIONS, 2020, 卷号: 3, 期号: 6, 页码: 2000035 作者: Zhao, Yingjie; Chen, Yuhong; Song, Mingxia; Liu, Xiaocong; Xu, Wenhui 收藏 \| 浏览/下载：8/0 \| 提交时间：2020/06/02 adsorption CH4 graphenes Mn-modified materials
	Density functional theory capture of electronic structures and optical properties of vacancy doped 3C-SiC systems 期刊论文 MATERIALS RESEARCH EXPRESS, 2019, 卷号: 6, 期号: 11 作者: Lu, Xuefeng; Yang, Panfeng; Luo, Jianhua; Guo, Xin; Ren, Junqiang 收藏 \| 浏览/下载：9/0 \| 提交时间：2020/06/02 3C-SiC electronic structures optical properties vacancy doping first-principles simulations
	Electronic structures and optical properties of Ni-doped 4H-SiC: dispersion-corrected density functional theory investigations 期刊论文 MATERIALS RESEARCH EXPRESS, 2019, 卷号: 6, 期号: 9 作者: Lu, Xuefeng; Zhao, Tingting; Guo, Xin; Chen, Meng; Ren, Junqiang 收藏 \| 浏览/下载：16/0 \| 提交时间：2019/11/15 first principles simulations 4H-SiC electronic structure optical properties
	Density functional study on electric structure and optical properties in Na-doped 3C-SiC 期刊论文 MODERN PHYSICS LETTERS B, 2019, 卷号: 33, 期号: 24 作者: Lu, Xuefeng; Luo, Jianhua; Yang, Panfeng; Zhao, Tingting 收藏 \| 浏览/下载：18/0 \| 提交时间：2019/11/15 Silicon carbide Na doping electronic structures optical properties first-principles simulations

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