Structure prediction in high-entropy alloys with machine learning
被引:36
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作者:
Zhao, D. Q.
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Taiyuan Univ Technol, Coll Mat Sci & Engn, Taiyuan 030024, Peoples R ChinaTaiyuan Univ Technol, Coll Mat Sci & Engn, Taiyuan 030024, Peoples R China
Zhao, D. Q.
[1
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Pan, S. P.
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机构:
Taiyuan Univ Technol, Coll Mat Sci & Engn, Taiyuan 030024, Peoples R China
Taiyuan Univ Technol, Key Lab Interface Sci & Engn Adv Mat, Minist Educ, Taiyuan 030024, Peoples R ChinaTaiyuan Univ Technol, Coll Mat Sci & Engn, Taiyuan 030024, Peoples R China
Pan, S. P.
[1
,2
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Zhang, Y.
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机构:
Univ Sci & Technol Beijing, State Key Lab Adv Met & Mat, Beijing 100083, Peoples R ChinaTaiyuan Univ Technol, Coll Mat Sci & Engn, Taiyuan 030024, Peoples R China
Zhang, Y.
[3
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Liaw, P. K.
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机构:
Univ Tennessee, Dept Mat Sci & Engn, Knoxville, TN 37996 USATaiyuan Univ Technol, Coll Mat Sci & Engn, Taiyuan 030024, Peoples R China
Liaw, P. K.
[4
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Qiao, J. W.
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Taiyuan Univ Technol, Coll Mat Sci & Engn, Taiyuan 030024, Peoples R China
Taiyuan Univ Technol, Key Lab Interface Sci & Engn Adv Mat, Minist Educ, Taiyuan 030024, Peoples R ChinaTaiyuan Univ Technol, Coll Mat Sci & Engn, Taiyuan 030024, Peoples R China
Qiao, J. W.
[1
,2
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机构:
[1] Taiyuan Univ Technol, Coll Mat Sci & Engn, Taiyuan 030024, Peoples R China
[2] Taiyuan Univ Technol, Key Lab Interface Sci & Engn Adv Mat, Minist Educ, Taiyuan 030024, Peoples R China
[3] Univ Sci & Technol Beijing, State Key Lab Adv Met & Mat, Beijing 100083, Peoples R China
[4] Univ Tennessee, Dept Mat Sci & Engn, Knoxville, TN 37996 USA
High-entropy alloy is an alloy design concept without a principal component. This concept not only refers to the complexity of alloy compositions but also means that when the high-entropy alloy transits from a high-energy state to low-energy state, there will be more intermediate metastable states. Corresponding to different states are the changes in the degree and manner of order in the microstructure. In this study, we used machine learning to combine elemental characteristics with long-term ordering and established 87% of prediction accuracy. This data-driven method can correlate elemental characteristics and metastable states and accelerate the discovery of potential compositions.
机构:
Arizona State Univ, Sch Engn Matter Transport & Energy, Artificial Intelligence Alloys Lab, Tempe, AZ 85287 USAArizona State Univ, Sch Engn Matter Transport & Energy, Artificial Intelligence Alloys Lab, Tempe, AZ 85287 USA
Huang, Wenjiang
Martin, Pedro
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Arizona State Univ, Sch Engn Matter Transport & Energy, Artificial Intelligence Alloys Lab, Tempe, AZ 85287 USAArizona State Univ, Sch Engn Matter Transport & Energy, Artificial Intelligence Alloys Lab, Tempe, AZ 85287 USA
Martin, Pedro
Zhuang, Houlong L.
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Arizona State Univ, Sch Engn Matter Transport & Energy, Artificial Intelligence Alloys Lab, Tempe, AZ 85287 USAArizona State Univ, Sch Engn Matter Transport & Energy, Artificial Intelligence Alloys Lab, Tempe, AZ 85287 USA
机构:
CSIR, Mfg Cluster, Adv Mat & Engn, POB 395, ZA-0001 Pretoria, South Africa
Univ Johannesburg, Sch Min Met & Chem Engn, Doornfontein Campus, ZA-2094 Johannesburg, South AfricaCSIR, Mfg Cluster, Adv Mat & Engn, POB 395, ZA-0001 Pretoria, South Africa
机构:
Arizona State Univ, Sch Engn Matter Transport & Energy, Tempe, AZ 85287 USAArizona State Univ, Sch Engn Matter Transport & Energy, Tempe, AZ 85287 USA
Brown, Payden
Zhuang, Houlong
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机构:
Arizona State Univ, Sch Engn Matter Transport & Energy, Tempe, AZ 85287 USAArizona State Univ, Sch Engn Matter Transport & Energy, Tempe, AZ 85287 USA
机构:
Lehigh Univ, Dept Phys, Bethlehem, PA 18015 USA
Lehigh Univ, Dept Mat Sci & Engn, Bethlehem, PA 18015 USALehigh Univ, Dept Phys, Bethlehem, PA 18015 USA
Rickman, J. M.
Balasubramanian, G.
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机构:
Lehigh Univ, Dept Mech Engn & Mech, Bethlehem, PA 18015 USALehigh Univ, Dept Phys, Bethlehem, PA 18015 USA
Balasubramanian, G.
Marvel, C. J.
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机构:
Lehigh Univ, Dept Mat Sci & Engn, Bethlehem, PA 18015 USALehigh Univ, Dept Phys, Bethlehem, PA 18015 USA
Marvel, C. J.
Chan, H. M.
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机构:
Lehigh Univ, Dept Mat Sci & Engn, Bethlehem, PA 18015 USALehigh Univ, Dept Phys, Bethlehem, PA 18015 USA
Chan, H. M.
Burton, M. -T.
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机构:
Lehigh Univ, Dept Mat Sci & Engn, Bethlehem, PA 18015 USALehigh Univ, Dept Phys, Bethlehem, PA 18015 USA