Atomistic structures of 〈0001〉 tilt grain boundaries in a textured Mg thin film

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Nanoscale, 2022, 14, 18192
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Crystallization mechanism of the Pt50Au50 alloy with grain boundary segregation during the solidification process

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Phys. Chem. Chem. Phys., 2023, 25, 27866
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Irradiation stability and induced ferromagnetism in a nanocrystalline CoCrCuFeNi highly-concentrated alloy

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Nanoscale, 2021, 13, 20437
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An analytical model of grain growth considering the conjoint effects of precipitate pinning and solute drag in steel

Joydeep Maity

Philosophical Magazine Letters, 2022, 102, 307
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Exploring solute behavior and texture selection in magnesium alloys at the atomistic level

F. Mouhib, Z. Xie, A. Atila, J. Guénolé, S. Korte-Kerzel and T. Al-Samman

Acta Materialia, 2024, 266, 119677
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The physical origin of heterogeneous solute clustering and nanoprecipitation at grain boundaries in ultrafine-grained immiscible alloys

Pavel Nikitin, Maxime Guinel de France and Frederic Sansoz

Scripta Materialia, 2026, 270, 116939
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Microstructural Analysis of K-TIG-Welded New Ni-Based Superalloy VDM Alloy 780

Achmad Ariaseta, Abdul Khaliq Khan, Joel Andersson and Olanrewaju Ojo

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Enhanced strengthening via nanoscale composition modulation

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Scripta Materialia, 2026, 271, 116999
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Solute clustering in polycrystals: Unveiling the interplay of grain boundary junction and long-range solute attraction effects

Tara Nenninger and Frederic Sansoz

Acta Materialia, 2025, 290, 120946
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Correlation between stabilizing and strengthening effects due to grain boundary segregation in iron-based alloys: Theoretical models and first-principles calculations

H.R. Peng, W.T. Huo, W. Zhang, Y. Tang, S. Zhang, L.K. Huang, H.Y. Hou, Z.G. Ding and F. Liu

Acta Materialia, 2023, 251, 118899
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Extreme Abnormal Grain Growth: Connecting Mechanisms to Microstructural Outcomes

Carl E. Krill, Elizabeth A. Holm, Jules M. Dake, Ryan Cohn, Karolína Holíková and Fabian Andorfer

Annu. Rev. Mater. Res., 2023, 53, 319
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Guided combinatorial synthesis and automated characterization expedites the discovery of hard, electrically conductive PtxAu1−x films

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Journal of Vacuum Science & Technology A, 2024, 42
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Role of Ag segregation on microscale strengthening and slip transmission in an asymmetric Σ5 copper grain boundary

Mohammed Kamran Bhat, Prithiv Thoudden Sukumar, Lena Langenohl, James P. Best and Gerhard Dehm

Acta Materialia, 2023, 255, 119081
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Orientation microscopy–assisted grain boundary analysis for protonic ceramic cell electrolytes

Sooraj Patel, Sumit Goswami, Pralay Paul, Fan Liu, Shuanglin Zheng, Julian E. Sabisch, Chuancheng Duan, Thirumalai Venkatesan, Hanjong Paik, Hanping Ding, Pejman Kazempoor, Shuozhi Xu, Dong Ding and Iman Ghamarian

J Am Ceram Soc., 2025, 108
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New insights into the character of austenite-ferrite boundaries in an additively manufactured duplex stainless steel

N. Haghdadi, A.J. Breen, H. Chen, F. Theska, W.J. Davids, X.Z. Liao, G.S. Rohrer, S.P. Ringer and S. Primig

Scripta Materialia, 2024, 245, 116049
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Grain boundary and twin boundary solute segregations in nanocrystalline Al-Mg alloy

X.Y. Sheng, Z. Shang, A.Y. Shang, H. Wang and X. Zhang

Scripta Materialia, 2024, 245, 116053
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Atomic-scale investigation of Pt composition on deformation mechanism of AuPt alloy during nano-scratching process

Changlin Liu, Zhuoxuan Zhuang, Juan Chen, W.S. Yip and Suet To

Surfaces and Interfaces, 2023, 40, 103126
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Atomic insight into mechanical behavior of AuPt alloys

Gangjie Luo, Yuanyuan Tian, Fulei Chen, Junfeng Liu, Shanyong Chen and Chunyang Du

International Journal of Mechanical Sciences, 2024, 263, 108778
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Grain boundary character dependence of phosphorus segregation at ferrite grain boundaries in a high-purity iron-phosphorus binary alloy

Yongjie Zhang, Kohei Ikeda, Shigeki Kitsuya, Goro Miyamoto and Tadashi Furuhara

Scripta Materialia, 2024, 249, 116170
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Size-dependent attraction of Cu solutes to clusters formed at Ag grain boundaries

Pavel Nikitin and Frederic Sansoz

Phys. Rev. Materials, 2025, 9
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Grain Boundary Solute Drag Model in Regular Solution Alloys

Malek Alkayyali and Fadi Abdeljawad

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Computed entropy spectra for grain boundary segregation in polycrystals

Nutth Tuchinda and Christopher A. Schuh

npj Comput Mater, 2024, 10
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Exploring solute segregation in sputtered W-10 at. % M (M=Ti, Ag, and Ta): Experimental insights and atomistic modeling

A.T. AlMotasem, N. Daghbouj, T. Huminiuc, J. Vesely, M. Karlik, M. Callisti, X. Zhang and T. Polcar

Materialia, 2025, 39, 102346
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Effect of elemental segregation on grain boundary cohesion in platinum: a first-principles study

Xin Yao, Ming Wen, Kai Xiong, Yong Mao and Ya-Fang Guo

Philosophical Magazine, 2025, 105, 895
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High-throughput multimodal exploration of a nanocrystalline Cu-Ag library

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Effect of Cr segregation on grain growth in nanocrystalline α-Fe alloy: A multiscale modeling approach

Sandip Guin, Albert Linda, Yu-Chieh Lo, Somanth Bhowmick and Rajdip Mukherjee

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Unveiling temperature-driven deformation mechanisms in AuPt20 nano-polycrystalline alloys through integrated molecular dynamics and experimental analysis

Pengtao Li, Ruihan Zhang, Yutong Song, Zhongyi Ding, Na Jin, Mingyang Hu, Yi Liu and Rui Hu

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Solute segregation in a moving grain boundary: a phase-field approach

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Ni solute segregation and associated plastic deformation mechanisms into random FCC Ag, BCC Nb and HCP Zr polycrystals

Eve-Audrey Picard and Frederic Sansoz

Acta Materialia, 2022, 240, 118367
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Computational modeling of grain boundary segregation: A review

Chongze Hu, Rémi Dingreville and Brad L. Boyce

Computational Materials Science, 2024, 232, 112596
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Segregation competition and complexion coexistence within a polycrystalline grain boundary network

Pulkit Garg, Zhiliang Pan, Vladyslav Turlo and Timothy J. Rupert

Acta Materialia, 2021, 218, 117213
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Stability of immiscible nanocrystalline alloys in compositional and thermal fields

J.M. Monti, E.M. Hopkins, K. Hattar, F. Abdeljawad, B.L. Boyce and R. Dingreville

Acta Materialia, 2022, 226, 117620
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Grain boundary solute segregation across the 5D space of crystallographic character

Lydia Harris Serafin, Ethan R. Cluff, Gus L.W. Hart and Eric R. Homer

Acta Materialia, 2025, 283, 120448
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Thermal stability of phase-separated nanograin structure during heat treatment

Hua Guo, Fawei Tang, Yong Liu, Zhi Zhao, Hao Lu, Chao Hou and Xiaoyan Song

Journal of Alloys and Compounds, 2021, 875, 160055
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Spinodal Decomposition in Nanocrystalline Alloys

Xuyang Zhou, Reza Darvishi Kamachali, Brad L. Boyce, Blythe G. Clark, Dierk Raabe and Gregory B. Thompson

Acta Materialia, 2021, 215, 117054
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Quantitative analysis of grain boundary diffusion, segregation and precipitation at a sub-nanometer scale

Zirong Peng, Thorsten Meiners, Yifeng Lu, Christian H. Liebscher, Aleksander Kostka, Dierk Raabe and Baptiste Gault

Acta Materialia, 2022, 225, 117522
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Unraveling Thermodynamic and Kinetic Contributions to the Stability of Doped Nanocrystalline Alloys using Nanometallic Multilayers

W. Streit Cunningham, Sean T. J. Mascarenhas, J. Sebastian Riano, Wenbo Wang, Sooyeon Hwang, Khalid Hattar, Andrea M. Hodge and Jason R. Trelewicz

Advanced Materials, 2022, 34
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The radiation instability of thermally stable nanocrystalline platinum gold

Ryan Schoell, Christopher M. Barr, Douglas L. Medlin, David P. Adams, Yasir Mahmood, Fadi Abdeljawad and Khalid Hattar

J Mater Sci, 2024, 59, 11497
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Solute synergy induced thermal stability of high-strength nanotwinned Al-Co-Zr alloys

N.A. Richter, Y.F. Zhang, M. Gong, T. Niu, B. Yang, S. Xue, J. Wang, H. Wang and X. Zhang

Materials Science and Engineering: A, 2023, 862, 144477
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Influence of the twin boundary and Cr segregation on the spalling of Ni-base alloys by large-scale molecular dynamic simulations

Huanwen Zhu, Kun Wang, Shifang Xiao, Xiaofan Li and Wangyu Hu

Journal of Applied Physics, 2023, 133
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The effect of Cr alloying on defect migration at Ni grain boundaries

Blas P. Uberuaga, Pauline Simonnin, Kevin M. Rosso, Daniel K. Schreiber and Mark Asta

J Mater Sci, 2022, 57, 10499
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Triple Junction Segregation Dominates the Stability of Nanocrystalline Alloys

Annie K. Barnett, Omar Hussein, Maher Alghalayini, Alejandro Hinojos, James E. Nathaniel, Douglas L. Medlin, Khalid Hattar, Brad L. Boyce and Fadi Abdeljawad

Nano Lett., 2024, 24, 9627
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Atomistic and machine learning studies of solute segregation in metastable grain boundaries

Yasir Mahmood, Maher Alghalayini, Enrique Martinez, Christiaan J. J. Paredis and Fadi Abdeljawad

Sci Rep, 2022, 12
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In-Situ EBSD Study the Effect of Aging Conditions on Deformation Coordination of Grain Boundaries in Al–Cu–Li Alloys

Xiaobin Guo, Linghan Meng and Yunlai Deng

Metall Mater Trans A, 2025, 56, 865
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A reversible solvent segregation transition at grain boundaries in gold-platinum alloys

Sebastian Calderon, Wen-Yu Chen, Md. Shariful Islam, Sai S. Tripathy, Maarten P. de Boer, Elizabeth C. Dickey and Gregory S. Rohrer

Scripta Materialia, 2025, 269, 116902
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Grain boundary segregation predicted by quantum-accurate segregation spectra but not by classical models

Malik Wagih, Yannick Naunheim, Tianjiao Lei and Christopher A. Schuh

Acta Materialia, 2024, 266, 119674
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Unconventional solute-matrix bonding at metallic polycrystal grain boundaries and their amorphous counterparts

Hao Wu, Xin Li, Wang Gao and Qing Jiang

Acta Materialia, 2025, 301, 121590
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First-principles study on segregation anisotropy of grain boundaries in Pt–Au alloys

Xin Yao, Ya-Fang Guo, Wei Li, Kalevi Kokko, Changle Li and Levente Vitos

Journal of Applied Physics, 2025, 137
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Gradient nanostructuring via compositional means

Alejandro Barrios, James E. Nathaniel, Joseph Monti, Zachary Milne, David P. Adams, Khalid Hattar, Douglas L. Medlin, Remi Dingreville and Brad L. Boyce

Acta Materialia, 2023, 247, 118733
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Synergistic effects of solutes on active deformation modes, grain boundary segregation and texture evolution in Mg-Gd-Zn alloys

F. Mouhib, R. Pei, B. Erol, F. Sheng, S. Korte-Kerzel and T. Al-Samman

Materials Science and Engineering: A, 2022, 847, 143348
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On the use of nanometer-scale multilayers to determine interdiffusion coefficients: Comprehensive characterization of interdiffusion at low temperature in the Ni–Cr system

T. Rieger, M. Nastar, A. Debelle, A. Michel, A. Billard and M. Loyer-Prost

Acta Materialia, 2023, 258, 119194
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Prevention of hot cracking in wire-arc additive manufacturing of iron-based shape memory alloy using a novel inter-layer machine hammer peening process

Soumyajit Koley and Supriyo Ganguly

Materials Science and Engineering: A, 2025, 937, 148453
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Understanding grain boundary segregation and solute drag using computational and machine learning studies

Malek Alkayyali, Milad Taghizadeh and Fadi Abdeljawad

Acta Materialia, 2024, 275, 120037
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Strengthening from dislocation restructuring and local climb at platelet linear complexions in Al-Cu alloys

Pulkit Garg, Daniel S. Gianola and Timothy J. Rupert

J Mater. Sci: Mater. Theory, 2024, 8
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Solute segregation improves the high-cycle fatigue resistance of nanocrystalline Pt-Au

Nathan M. Heckman, Alejandro Barrios, Christopher M. Barr, David P. Adams, Timothy A. Furnish, Khalid Hattar and Brad L. Boyce

Acta Materialia, 2022, 229, 117794
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Localized engineering of grain boundary morphology by electro-nano-pulsing processing

Wenwu Xu, Runjian Jiang, Mingjie Xu, Md Shahrier Hasan, Kyrel Polifrone, Jing Gu, Yang Yang, Elisa Torresani and Eugene Olevsky

Materials Today Advances, 2023, 20, 100442
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