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	Thermodynamic Phase Diagrams of Ternary Alloys Exposed to a Single Oxidant 期刊论文 OXIDATION OF METALS, 2019, 卷号: 92, 期号: 3-4, 页码: 195-225 作者: Shen, Jun; Guo, Xiaohui; Niu, Yan 收藏 \| 浏览/下载：17/0 \| 提交时间：2021/02/02 Ternary alloys Thermodynamic diagrams Oxidation Phase equilibrium
	On the abnormal fast diffusion of solute atoms in alpha-Ti: A first-principles investigation 期刊论文 JOURNAL OF ALLOYS AND COMPOUNDS, 2018, 卷号: 740, 页码: 156-166 作者: Zhang, LJ; Chen, ZY; Hu, QM; Yang, R; Hu, QM (reprint author), Chinese Acad Sci, Inst Met Res, Shenyang Natl Lab Mat Sci, 72 Wenhua Rd, Shenyang 110016, Liaoning, Peoples R China. 收藏 \| 浏览/下载：44/0 \| 提交时间：2018/06/05 Grain-boundary Segregation Austenitic Stainless-steel Total-energy Calculations Augmented-wave Method Elastic Band Method Alloying Elements Self-diffusion Impurity Diffusion 1st Principles Saddle-points
	Local lattice distortion in high-entropy alloys 期刊论文 AMER PHYSICAL SOC, 2017, 卷号: 1, 期号: 2, 页码: - 作者: Song, Hongquan; Tian, Fuyang; Hu, Qing-Miao; Vitos, Levente; Wang, Yandong 收藏 \| 浏览/下载：14/0 \| 提交时间：2018/01/10
	Blade bowing effects on radial equilibrium of inlet flow in axial compressor cascades 期刊论文 Chinese Journal of Aeronautics, 2017, 卷号: 30, 期号: 5, 页码: 1651-1659 作者: Xu Han; Chang Hao; Jin Donghai; Gui Xingmin 收藏 \| 浏览/下载：11/0 \| 提交时间：2021/02/02 Axial compressor Bowing Cascade Circumferential fluctuation Inlet flow Radial equilibrium Motor vehicles. Aeronautics. Astronautics TL1-4050
	Density-functional theory study of structures, stabilities, and electronic properties of the Cu-2-doped silicon clusters: Comparison with pure silicon clusters 期刊论文 Physica B-Condensed Matter, 2012, 卷号: 407, 期号: 21, 页码: 4379-4386 P. Shao; X. Y. Kuang; L. P. Ding; M. M. Zhong; Z. H. Wang 收藏 \| 浏览/下载：14/0 \| 提交时间：2013/02/05 Density functional theory Cu-Si cluster Geometric configuration laser-absorption spectroscopy flight mass-spectroscopy supersonic molecular-beam doped germanium clusters si cage clusters copper silicides geometries
	Equilibrium geometries, stabilities, and electronic properties of the cationic AunBe+ (n=1-8) clusters: comparison with pure gold clusters 期刊论文 Journal of Molecular Modeling, 2012, 卷号: 18, 期号: 8, 页码: 3553-3562 P. Shao; X. Y. Kuang; Y. R. Zhao; Y. F. Li; S. J. Wang 收藏 \| 浏览/下载：24/0 \| 提交时间：2013/02/05 AunBe+ cluster Density functional method Geometrical configuration ground-state beryllium dimer co oxidation transition chemistry polarizabilities au-n(+) atoms be-2 cs
	Equilibrium Geometries, Stabilities, and Electronic Properties of the Bimetallic Ag-2-doped Si-n (n=1-11) Clusters: A Density-Functional Investigation 期刊论文 ZEITSCHRIFT FUR NATURFORSCHUNG SECTION A-A JOURNAL OF PHYSICAL SCIENCES, 2011, 卷号: 66, 期号: 5, 页码: 353-362 作者: Zhao, Ya-Ru; Kuang, Xiao-Yu; Wang, Su-Juan; Li, Yan-Fang; Lu, Peng 收藏 \| 浏览/下载：10/0 \| 提交时间：2021/02/02 Ag-Si Cluster Geometric Configuration Density Function Method
	First-principles investigation of the electronic structure and magnetism of Heusler alloys CoMnSb and Co2MnSb 期刊论文 PHYSICA B-CONDENSED MATTER, 2011, 卷号: 406, 期号: 8, 页码: 1368-1373 作者: Huang, H. M.; Luo, S. J.; Yao, K. L. 收藏 \| 浏览/下载：9/0 \| 提交时间：2021/02/02 First-principles Magnetic properties Half-metallic properties
	Equilibrium Geometries, Stabilities, and Electronic Properties of the Bimetallic Ag(2)-doped Si(n) (n=1-11) Clusters: A Density-Functional Investigation 期刊论文 Zeitschrift Fur Naturforschung Section a-a Journal of Physical Sciences, 2011, 卷号: 66, 期号: 5, 页码: 353-362 Y. R. Zhao; X. Y. Kuang; S. J. Wang; Y. F. Li; P. Lu 收藏 \| 浏览/下载：11/0 \| 提交时间：2012/04/13 Ag-Si Cluster Geometric Configuration Density Function Method laser-absorption spectroscopy flight mass-spectroscopy supersonic molecular-beam small silicon clusters gold silicides copper silicide states silver ions
	First-principles investigation of the electronic structure and magnetism of Heusler alloys CoMnSb and Co(2)MnSb 期刊论文 Physica B-Condensed Matter, 2011, 卷号: 406, 期号: 8, 页码: 1368-1373 H. M. Huang; S. J. Luo; K. L. Yao 收藏 \| 浏览/下载：14/0 \| 提交时间：2012/04/13 First-principles Magnetic properties Half-metallic properties half-metallic ferrimagnetism thin-films co(2)mnz z ga ge al si sn prediction phase

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