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	Adsorption of Oxygen on Low-Index Surfaces of the TiAl3 Alloy 期刊论文 JOURNAL OF EXPERIMENTAL AND THEORETICAL PHYSICS, 2016, 卷号: 123, 期号: 6, 页码: 991-1007 作者: Latyshev, A. M.; Bakulin, A. V.; Kulkova, S. E.; Hu, Q. M.; Yang, R. 收藏 \| 浏览/下载：9/0 \| 提交时间：2021/02/02
	Point defects in TiNi-based alloys from ab-initio calculations 期刊论文 MATERIALS TODAY-PROCEEDINGS, 2015, 卷号: 2, 页码: 615-618 Kulkova, S. E.; Bakulin, A. V.; Hu, Q. M.; Yang, R. 收藏 \| 浏览/下载：17/0 \| 提交时间：2016/04/21 point defects electronic structure TiNi-based alloys
	Adsorption and diffusion of oxygen on gamma-TiAl(001) and (100) surfaces 期刊论文 Computational Materials Science, 2015, 卷号: 97, 页码: 55-63 S. E. Kulkova; A. V. Bakulin; Q. M. Hu; R. Yang 收藏 \| 浏览/下载：21/0 \| 提交时间：2015/01/14 Adsorption TiAl surfaces Oxygen diffusion Electronic structure density-functional theory total-energy calculations titanium-aluminum-alloys wave basis-set oxidation behavior ti-al initial oxidation elastic-constants 1st-principles hydrogen
	Theoretical study of oxygen sorption and diffusion in the volume and on the surface of a gamma-TiAl alloy 期刊论文 Journal of Experimental and Theoretical Physics, 2015, 卷号: 120, 期号: 2, 页码: 257-267 A. V.; Kulkova Bakulin, S. E.; Hu, Q. M.; Yang, R. 收藏 \| 浏览/下载：15/0 \| 提交时间：2015/05/08 total-energy calculations wave basis-set titanium aluminides oxidation behavior initial oxidation elastic-constants al adsorption hydrogen system
	First-principles investigations of oxygen adsorption at TiNi surface and the TiO2/TiO-TiNi interface 期刊论文 Physica B-Condensed Matter, 2013, 卷号: 426, 页码: 118-126 S. E. Kulkova; A. V. Bakulin; Q. M. Hu; R. Yang 收藏 \| 浏览/下载：10/0 \| 提交时间：2013/12/24 Electronic structure TiNi Oxidation Interface Defects total-energy calculations augmented-wave method low-index surfaces basis-set
	First-principles investigations of the five-layer modulated martensitic structure in Ni2Mn(AlxGa1-x) alloys 期刊论文 ACTA MATERIALIA, 2011, 卷号: 59, 期号: 15, 页码: 5938-5945 作者: Luo, H. B.; Li, C. M.; Hu, Q. M.; Kulkova, S. E.; Johansson, B. 收藏 \| 浏览/下载：67/0 \| 提交时间：2021/02/02 Heusler alloy First-principles calculations Modulated structure Martensitic transformation Shape memory alloys (SMA)
	First-principles investigations of the five-layer modulated martensitic structure in Ni(2)Mn(Al(x)Ga(1-x)) alloys 期刊论文 Acta Materialia, 2011, 卷号: 59, 期号: 15, 页码: 5938-5945 H. B. Luo; C. M. Li; Q. M. Hu; S. E. Kulkova; B. Johansson; L. Vitos; R. Yang 收藏 \| 浏览/下载：22/0 \| 提交时间：2012/04/13 Heusler alloy First-principles calculations Modulated structure Martensitic transformation Shape memory alloys (SMA) ni-mn-ga magnetic shape-memory field-induced strain crystal-structures heusler alloys phase-transformation potential model ni2mnga approximation transition
	First-principles investigations of the five-layer modulated martensitic structure in Ni2Mn(AlxGa1-x) alloys 期刊论文 ACTA MATERIALIA, 2011, 卷号: 59, 页码: 5938-5945 作者: Luo, H. B.; Li, C. M.; Hu, Q. M.; Kulkova, S. E.; Johansson, B. 收藏 \| 浏览/下载：3/0 \| 提交时间：2019/12/18 Heusler alloy First-principles calculations Modulated structure Martensitic transformation Shape memory alloys (SMA)
	Magnetoelastic effects in Ni(2)Mn(1+x)Ga(1-x) alloys from first-principles calculations 期刊论文 Physical Review B, 2010, 卷号: 81, 期号: 6 Q. M. Hu; C. M. Li; S. E. Kulkova; R. Yang; B. Johansson; L. Vitos 收藏 \| 浏览/下载：17/0 \| 提交时间：2012/04/13 shape-memory alloys electronic-structure martensitic phase potential model heusler alloys ni2mnga transformation approximation strain
	Site occupancy, magnetic moments, and elastic constants of off-stoichiometric Ni(2)MnGa from first-principles calculations 期刊论文 Physical Review B, 2009, 卷号: 79, 期号: 14 Q. M. Hu; C. M. Li; R. Yang; S. E. Kulkova; D. I. Bazhanov; B. Johansson; L. Vitos 收藏 \| 浏览/下载：22/0 \| 提交时间：2012/04/13 density functional theory elastic constants elastic moduli ferromagnetic materials gallium alloys linear muffin-tin orbital method magnetic moments magnetomechanical effects manganese alloys martensitic transformations nickel alloys shape memory effects shear modulus stoichiometry shape-memory alloys ni-mn-ga martensitic-transformation phase-transformations potential model heusler alloys landau theory transition metals approximation

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