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RESEARCH PAPER · Chemistry of Materials · 2020

Modeling Exsolution of Pt from ATiO3 Perovskites (A = Ca/Sr/Ba) Using First-Principles Methods

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Modeling Exsolution of Pt from ATiO3 Perovskites (A = Ca/Sr/Ba) Using First-Principles MethodsOriginalMetal Exsolution to Enhance the Catalytic Activity of Electrodes in Solid Oxide Fuel Cells55Tuning Point Defects by Elastic Strain Modulates Nanoparticle Exsolution on Perovskite Oxides93Exsolution Synthesis of Nanocomposite Perovskites with Tunable Electrical and Magnetic Properties45Exsolution: A promising strategy for constructing advanced composite solids16Exsolution-Driven Surface Transformation in the Host Oxide51Specific applications of the lanthanides0Quantum Chemical Modeling of CH3NH3MX3 (MAM*X3: M* = Sn, Si, Ge; X = Cl, Br, I) Lead-Free Perovskites in Comparison with Lead-Based Perovskite Materials7Roadmap on exsolution for energy applications71Co-Exsolution of Ni-Based Alloy Catalysts for the Valorization of Carbon Dioxide and Methane33Nanoparticle Exsolution on Perovskite Oxides: Insights into Mechanism, Characteristics and Novel Strategies102Detonation performance and shock sensitivity of energetic material NTO with embedded small molecules: a deep neural network potential accelerated molecular dynamics study11Stability of Pd x O y Particles Supported on Strontium Titanate Perovskite under Three-Way Catalyst Operating Conditions: Implications for Sintering Resistance13Local Structures of Ex-Solved Nanoparticles Identified by Machine-Learned Potentials9Accelerated Discovery of Halide Perovskite Materials via Computational Methods: A Review37The effects of nano-socketed metal particles over perovskite surfaces on the electrochemical synthesis of high-value fuels13Self-Reconstruction Mechanism of High-Entropy Oxide in Glycerol Steam Reforming: The Key to H 2 -rich Syngas Production20Surface reconstruction of versatile perovskites via in situ nanoparticle engineering for solid oxide cells4Surface Segregation Trends in Doped Perovskite Titanates1Charge-Buffered Lattice Enabled Redox-Stable Ni/Perovskite-CaO Dual-Functional Materials for Integrated CO 2 Capture and Conversion6Electrode surface engineering for proton-conducting ceramic cells: Advances and perspectives1Lattice Distortion‐Driven Metal Exsolution in Perovskite Oxides2

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  1. Metal Exsolution to Enhance the Catalytic Activity of Electrodes in Solid Oxide Fuel Cells

    Nanomaterials · 2020-12-07

    Tianyu Cao, Ohhun Kwon, Raymond J. Gorte, John M. Vohs

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  2. Tuning Point Defects by Elastic Strain Modulates Nanoparticle Exsolution on Perovskite Oxides

    Chemistry of Materials · 2021-06-15

    Jiayue Wang, Jing Yang, Alexander Karl Opitz, William J. Bowman, Roland Bliem, Georgios Dimitrakopoulos, Andreas Nenning, Iradwikanari Waluyo, Adrian H. Hunt, Jean‐Jacques Gallet, Bilge Yildiz

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  3. Exsolution Synthesis of Nanocomposite Perovskites with Tunable Electrical and Magnetic Properties

    Advanced Functional Materials · 2021-11-18

    Jiayue Wang, Komal Syed, Shuai Ning, Iradwikanari Waluyo, Adrian H. Hunt, Ethan J. Crumlin, Alexander Karl Opitz, Caroline Anne Ross, William J. Bowman, Bilge Yildiz

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  4. Exsolution: A promising strategy for constructing advanced composite solids

    Materials Today Sustainability · 2022-06-03

    Rui Lv, Zhengyan Guo, Xianglin Hou, Xiaofeng Wu, Kai Huang, Shouhua Feng

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  5. Exsolution-Driven Surface Transformation in the Host Oxide

    Nano Letters · 2022-06-30

    Jiayue Wang, Abinash Kumar, Jenna L. Wardini, Zhan Zhang, Hua Zhou, Ethan J. Crumlin, Jerzy T. Sadowski, Kevin Benjamin Woller, William J. Bowman, James M. LeBeau, Bilge Yildiz

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  6. Specific applications of the lanthanides

    Elsevier eBooks · 2023-01-01

    Peng Cheng

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  7. Quantum Chemical Modeling of CH3NH3MX3 (MAM*X3: M* = Sn, Si, Ge; X = Cl, Br, I) Lead-Free Perovskites in Comparison with Lead-Based Perovskite Materials

    Chemistry Africa · 2023-04-12

    Hitler Louis, Tomsmith O. Unimuke, J. Onyinye Ikenyirimba, Gideon E. Mathias, Adedapo Sunday Adeyinka

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  8. Roadmap on exsolution for energy applications

    Journal of Physics Energy · 2023-04-28

    Dragos Neagu, John T. S. Irvine, Jiayue Wang, Bilge Yildiz, Alexander Karl Opitz, Jürgen Fleig, Yuhao Wang, Jiapeng Liu, Longyun Shen, Francesco Ciucci, Brian Ashley Rosen, Yongchun Xiao, Kui Xie, Guangming Yang, Zongping Shao, Yubo Zhang, Jakob Michael Reinke, Travis Anthony Schmauss, Scott Alexander Barnett, Roelf Maring, Vasileios Kyriakou, Usman Mushtaq, Mihalis N. Tsampas, Youdong Kim, Ryan O’Hayre, Alfonso J. Carrillo, Thomas Ruh, Lorenz Lindenthal, Florian Schrenk, Christoph Rameshan, Evangelos I. Papaioannou, Kalliopi Kousi, Ian S. Metcalfe, Xiaoxiang Xu, Gang Yu Liu

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  9. Co-Exsolution of Ni-Based Alloy Catalysts for the Valorization of Carbon Dioxide and Methane

    Accounts of Chemical Research · 2023-11-08

    Musa O. Najimu, Seong Bin Jo, Kandis Leslie Gilliard‐AbdulAziz

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  10. Nanoparticle Exsolution on Perovskite Oxides: Insights into Mechanism, Characteristics and Novel Strategies

    Nano-Micro Letters · 2023-11-28

    Yo Han Kim, Hyeongwon Jeong, Bo‐Ram Won, Hyejin Jeon, Chan‐ho Park, Dayoung Park, Yeeun Kim, Somi Lee, Jae‐ha Myung

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  11. Detonation performance and shock sensitivity of energetic material NTO with embedded small molecules: a deep neural network potential accelerated molecular dynamics study

    Physical Chemistry Chemical Physics · 2024-01-01

    Caimu Wang, Jidong Zhang, Wei Guo, Ruibin Liu, Yugui Yao

    Read original paper ↗ ·
  12. Stability of Pd x O y Particles Supported on Strontium Titanate Perovskite under Three-Way Catalyst Operating Conditions: Implications for Sintering Resistance

    ACS Catalysis · 2024-01-12

    Thanh Ngoc Pham, Beatriz Andrea Choi Tan, Yuji Hamamoto, Kouji Inagaki, Ikutaro Hamada, Yoshitada Morikawa

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  13. Local Structures of Ex-Solved Nanoparticles Identified by Machine-Learned Potentials

    Nano Letters · 2024-04-01

    Sungwoo Kang, Jun Kyu Kim, Hyun‐Ah Kim, You‐Hwan Son, Jaehee Chang, Jinwoo Kim, Dongwook Kim, Jong-Min Lee, Hyuk Jae Kwon

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  14. Accelerated Discovery of Halide Perovskite Materials via Computational Methods: A Review

    Nanomaterials · 2024-07-08

    Ming Wei Sheng, Hui Zhu, Suqin Wang, Zhuang Liu, G.H. Zhou

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  15. The effects of nano-socketed metal particles over perovskite surfaces on the electrochemical synthesis of high-value fuels

    Journal of Power Sources · 2024-08-28

    Shuo Liu, Linbo Liu, Yu-Feng Tang, Qinglin Pan, Yifei Sun, Xian‐Zhu Fu, Jing‐Li Luo, Subiao Liu

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  16. Self-Reconstruction Mechanism of High-Entropy Oxide in Glycerol Steam Reforming: The Key to H 2 -rich Syngas Production

    ACS Catalysis · 2025-03-07

    Mingzheng Liao, Chao Wang, Ying Ian Chen, Yanyu Chen, Chunrun Qin, Yingwei Li

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  17. Surface reconstruction of versatile perovskites via in situ nanoparticle engineering for solid oxide cells

    Chem Catalysis · 2025-07-01

    Boshen Xu, Jiufeng Ruan, Pengxi Zhu, Sidong Lei, Hanping Ding, Pei Tao Dong

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  18. Surface Segregation Trends in Doped Perovskite Titanates

    Advanced Theory and Simulations · 2026-03-01

    Bader A. Alayyoub, Yingjie Shi, R G Ramesh, Adel S. Aldossari, Anthony Curto, Eric Chen, Larissa M. Woryk, Robert J. Tannenbaum, Roopal Bhatnagar, Satvik Gadamsetty, Unnati A. Joshi, Vidyanand Wagh, Abhinav S. Raman, Aleksandra Vojvodić

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  19. Charge-Buffered Lattice Enabled Redox-Stable Ni/Perovskite-CaO Dual-Functional Materials for Integrated CO 2 Capture and Conversion

    ACS Catalysis · 2026-03-05

    Fangshu He, Guijiang Yang, Zizhao Chen, Yingquan Chen, Haiping Yang, Yang Yang

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  20. Electrode surface engineering for proton-conducting ceramic cells: Advances and perspectives

    APL Energy · 2026-04-02

    Atif Khan Niaz, Megan L. Cunningham, Maximilian Rothfarb, Yudong Wang, Nengneng Xu, Hyung-Tae Lim, Xiao‐Dong Zhou

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  21. Lattice Distortion‐Driven Metal Exsolution in Perovskite Oxides

    Advanced Science · 2026-06-01

    Yo Han Kim, Uchan Jeon, Hyeongwon Jeong, Bo‐Ram Won, Jeong Woo Han, Jae‐ha Myung

    Read original paper ↗ ·