Unveiling the mechanisms of solid-solution strengthening in Ti alloys with dual-phase structures: an in-depth first-principles investigation.
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| Title: | Unveiling the mechanisms of solid-solution strengthening in Ti alloys with dual-phase structures: an in-depth first-principles investigation. |
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| Authors: | Xiang, Chumeng1,2 (AUTHOR), Li, Peixuan1 (AUTHOR), Jia, Dia1 (AUTHOR), Zou, Chengxiong1,2 (AUTHOR) zcx2016@mail.nwpu.edu.cn, Wang, William Yi1,2 (AUTHOR) wywang@nwpu.edu.cn, Li, Jinshan1,2 (AUTHOR) ljsh@nwpu.edu.cn |
| Source: | Journal of Materials Science. Feb2025, Vol. 60 Issue 6, p3096-3112. 17p. |
| Subjects: | Electron work function, Electronic density of states, Solution strengthening, Young's modulus, Heat of formation |
| Abstract: | Titanium alloys have been widely used in the aerospace industry attributing to their superior mechanical properties. Conducted from a microscopic perspective, this work unveils the objective laws and intrinsic mechanisms of solid-solution strengthening in dual-phase Ti alloys. This study delves into β-Ti95X and α-Ti95X alloys, where X represents Al, Cr, Mo, Nb, and V. The basic physical properties including lattice constants, equilibrium volume, bulk modulus (B0), enthalpy of formation (ΔH), lattice distortion energy (ΔELD), electron work function (EWF), and bonding characteristics are analyzed. The results indicate that the α phase exhibits greater stability compared to the β phase due to differences in crystal structure. However, solid solution strengthening is more pronounced in the β phase, where larger solute atoms induce greater lattice distortion, significantly influencing the mechanical properties of Ti alloys. Further insights are gained by analyzing the bonding charge density and electronic density of states, providing a deeper understanding of the interactions between solute atoms and Ti atoms. Moreover, a power-law model is established between Young's modulus (E) and EWF, providing essential theoretical and data support for the development of new high-performance Ti alloys. [ABSTRACT FROM AUTHOR] |
| Copyright of Journal of Materials Science is the property of Springer Nature and its content may not be copied or emailed to multiple sites without the copyright holder's express written permission. Additionally, content may not be used with any artificial intelligence tools or machine learning technologies. However, users may print, download, or email articles for individual use. This abstract may be abridged. No warranty is given about the accuracy of the copy. Users should refer to the original published version of the material for the full abstract. (Copyright applies to all Abstracts.) | |
| Database: | Engineering Source |
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| Header | DbId: egs DbLabel: Engineering Source An: 182882428 AccessLevel: 6 PubType: Academic Journal PubTypeId: academicJournal PreciseRelevancyScore: 0 |
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| Items | – Name: Title Label: Title Group: Ti Data: Unveiling the mechanisms of solid-solution strengthening in Ti alloys with dual-phase structures: an in-depth first-principles investigation. – Name: Author Label: Authors Group: Au Data: <searchLink fieldCode="AR" term="%22Xiang%2C+Chumeng%22">Xiang, Chumeng</searchLink><relatesTo>1,2</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Li%2C+Peixuan%22">Li, Peixuan</searchLink><relatesTo>1</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Jia%2C+Dia%22">Jia, Dia</searchLink><relatesTo>1</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Zou%2C+Chengxiong%22">Zou, Chengxiong</searchLink><relatesTo>1,2</relatesTo> (AUTHOR)<i> zcx2016@mail.nwpu.edu.cn</i><br /><searchLink fieldCode="AR" term="%22Wang%2C+William+Yi%22">Wang, William Yi</searchLink><relatesTo>1,2</relatesTo> (AUTHOR)<i> wywang@nwpu.edu.cn</i><br /><searchLink fieldCode="AR" term="%22Li%2C+Jinshan%22">Li, Jinshan</searchLink><relatesTo>1,2</relatesTo> (AUTHOR)<i> ljsh@nwpu.edu.cn</i> – Name: TitleSource Label: Source Group: Src Data: <searchLink fieldCode="JN" term="%22Journal+of+Materials+Science%22">Journal of Materials Science</searchLink>. Feb2025, Vol. 60 Issue 6, p3096-3112. 17p. – Name: Subject Label: Subjects Group: Su Data: <searchLink fieldCode="DE" term="%22Electron+work+function%22">Electron work function</searchLink><br /><searchLink fieldCode="DE" term="%22Electronic+density+of+states%22">Electronic density of states</searchLink><br /><searchLink fieldCode="DE" term="%22Solution+strengthening%22">Solution strengthening</searchLink><br /><searchLink fieldCode="DE" term="%22Young's+modulus%22">Young's modulus</searchLink><br /><searchLink fieldCode="DE" term="%22Heat+of+formation%22">Heat of formation</searchLink> – Name: Abstract Label: Abstract Group: Ab Data: Titanium alloys have been widely used in the aerospace industry attributing to their superior mechanical properties. Conducted from a microscopic perspective, this work unveils the objective laws and intrinsic mechanisms of solid-solution strengthening in dual-phase Ti alloys. This study delves into β-Ti95X and α-Ti95X alloys, where X represents Al, Cr, Mo, Nb, and V. The basic physical properties including lattice constants, equilibrium volume, bulk modulus (B0), enthalpy of formation (ΔH), lattice distortion energy (ΔELD), electron work function (EWF), and bonding characteristics are analyzed. The results indicate that the α phase exhibits greater stability compared to the β phase due to differences in crystal structure. However, solid solution strengthening is more pronounced in the β phase, where larger solute atoms induce greater lattice distortion, significantly influencing the mechanical properties of Ti alloys. Further insights are gained by analyzing the bonding charge density and electronic density of states, providing a deeper understanding of the interactions between solute atoms and Ti atoms. Moreover, a power-law model is established between Young's modulus (E) and EWF, providing essential theoretical and data support for the development of new high-performance Ti alloys. [ABSTRACT FROM AUTHOR] – Name: AbstractSuppliedCopyright Label: Group: Ab Data: <i>Copyright of Journal of Materials Science is the property of Springer Nature and its content may not be copied or emailed to multiple sites without the copyright holder's express written permission. Additionally, content may not be used with any artificial intelligence tools or machine learning technologies. However, users may print, download, or email articles for individual use. This abstract may be abridged. No warranty is given about the accuracy of the copy. Users should refer to the original published version of the material for the full abstract.</i> (Copyright applies to all Abstracts.) |
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| RecordInfo | BibRecord: BibEntity: Identifiers: – Type: doi Value: 10.1007/s10853-025-10602-5 Languages: – Code: eng Text: English PhysicalDescription: Pagination: PageCount: 17 StartPage: 3096 Subjects: – SubjectFull: Electron work function Type: general – SubjectFull: Electronic density of states Type: general – SubjectFull: Solution strengthening Type: general – SubjectFull: Young's modulus Type: general – SubjectFull: Heat of formation Type: general Titles: – TitleFull: Unveiling the mechanisms of solid-solution strengthening in Ti alloys with dual-phase structures: an in-depth first-principles investigation. Type: main BibRelationships: HasContributorRelationships: – PersonEntity: Name: NameFull: Xiang, Chumeng – PersonEntity: Name: NameFull: Li, Peixuan – PersonEntity: Name: NameFull: Jia, Dia – PersonEntity: Name: NameFull: Zou, Chengxiong – PersonEntity: Name: NameFull: Wang, William Yi – PersonEntity: Name: NameFull: Li, Jinshan IsPartOfRelationships: – BibEntity: Dates: – D: 08 M: 02 Text: Feb2025 Type: published Y: 2025 Identifiers: – Type: issn-print Value: 00222461 Numbering: – Type: volume Value: 60 – Type: issue Value: 6 Titles: – TitleFull: Journal of Materials Science Type: main |
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