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Papers citing Machine learning in materials design: Algorithm and application*

  1. Efficient sampling for decision making in materials discovery*

    Chinese Physics B · 2021

    Yuan Tian, Turab Lookman, Dezhen Xue

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  2. Machine Learning in Magnetic Materials

    physica status solidi (b) · 2021

    Georgios Katsikas, C. Sarafidis, Joseph Kioseoglou

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  3. Machine Learning of Quasiparticle Energies in Molecules and Clusters

    Journal of Chemical Theory and Computation · 2021

    Onur Çaylak, Björn Baumeier

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  4. Novel Materials for Urban Farming

    Advanced Materials · 2021

    Lifei Xi, Mengyuan Zhang, L. Zhang, Tedrick Thomas Salim Lew, Yeng Ming Lam

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  5. A universal neural network for learning phases

    The European Physical Journal Plus · 2021

    D.-R. Tan, J.-H. Peng, Y.-H. Tseng, Fu-Jiun Jiang

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  6. Going Beyond the d‐Band Center to Describe CO2 Activation on Single‐Atom Alloys

    Advanced Energy and Sustainability Research · 2021

    Zhongti Sun, Zhilong Song, Wan‐Jian Yin

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  7. Accelerated prediction of Cu-based single-atom alloy catalysts for CO2 reduction by machine learning

    Green Energy & Environment · 2021

    Dashuai Wang, Runfeng Cao, Shaogang Hao, Chen Liang, Guangyong Chen, Pengfei Chen, Yang Li, Xiaolong Zou

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  8. Mechanistic Data Science for Modeling and Design of Aerospace Composite Materials

    arXiv (Cornell University) · 2021

    Satyajit Mojumder, Lei Tao, Ying Li, Wing Kam Liu

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  9. Accurate Prediction of the Boiling Point of Organic Molecules by Multi-Component Heterogeneous Learning Model

    化学学报 · 2022

    Yuze Liu, Kunhua Li, Jiaxing Huang, Xi Yu, Wenping Hu

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  10. Modelling of functional properties of shape-memory alloys by machine learning methods

    Scientific journal of the Ternopil national technical university · 2022

    Oleh Yasniy, Vladyslav Demchyk, Nadiia Lutsyk

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  11. A machine learning model for screening thermodynamic stable lead-free halide double perovskites

    Computational Materials Science · 2022

    Gui-Qin Liang, Jian Zhang

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  12. Perspective: Predicting and optimizing thermal transport properties with machine learning methods

    Energy and AI · 2022

    Wei Han, Hua Bao, Xiulin Ruan

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  13. Data-Driven Construction Method of Material Mechanical Behavior Model

    Metals · 2022

    Qu Meijiao, Mengqi Li, Zhichao Wen, Weifeng He

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  14. A comparison of explainable artificial intelligence methods in the phase classification of multi-principal element alloys

    Scientific Reports · 2022

    Kyungtae Lee, Mukil V. Ayyasamy, Yangfeng Ji, Prasanna V. Balachandran

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  15. Digital advancements in smart materials design and multifunctional coating manufacturing

    Physics Open · 2022

    Jaya Verma, A.S. Khanna

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  16. Predicting the Textural Properties of Plant-Based Meat Analogs with Machine Learning

    Foods · 2023

    Sezin Kircali Ata, Jing Shi, Xuesi Yao, Xin Yi Hua, Sumanto Haldar, Jie Hong Chiang, Min Wu

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  17. Latest Advances in Manufacturing and Machine Learning of Bulk Metallic Glasses

    Advanced Engineering Materials · 2023

    Olivia A. Graeve, Mireya S. García-Vázquez, Alejandro Álvaro Ramírez‐Acosta, Zachary Cadieux

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  18. Advances in machine learning-aided design of reinforced polymer composite and hybrid material systems

    Hybrid Advances · 2023

    Christian Emeka Okafor, Sunday Iweriolor, Okwuchukwu Innocent Ani, Shahnawaz Ahmad, Shabana Mehfuz, Godspower Onyekachukwu Ekwueme, Okechukwu Emmanuel Chukwumuanya, Sylvester Emeka Abonyi, Ignatius Echezona Ekengwu, Peter Okechukwu Chikelu

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  19. Machine Learning for Perovskite Solar Cells and Component Materials: Key Technologies and Prospects

    Advanced Functional Materials · 2023

    Yiming Liu, Xinyu Tan, Jie Liang, Hongwei Han, Peng Xiang, Wensheng Yan

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  20. Predicting thermodynamic stability of magnesium alloys in machine learning

    Computational Materials Science · 2023

    Xi He, Jinde Liu, Yang Chen, Gang Jiang

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  21. Adaptive Design of Alloys for CO 2 Activation and Methanation via Reinforcement Learning Monte Carlo Tree Search Algorithm

    The Journal of Physical Chemistry Letters · 2023

    Zhilong Song, Qionghua Zhou, Shuaihua Lu, Sae Dieb, Chongyi Ling, Jinlan Wang

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  22. Advances in machine learning- and artificial intelligence-assisted material design of steels

    International Journal of Minerals Metallurgy and Materials · 2023

    Guangfei Pan, Feiyang Wang, Chunlei Shang, Hong‐Hui Wu, Guilin Wu, Junheng Gao, Shuize Wang, Zhijun Gao, Xiaoye Zhou, Xinping Mao

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  23. Machine Learning Accelerated Study of Defect Energy Levels in Perovskites

    The Journal of Physical Chemistry C · 2023

    Xiaoyu Wu, Haiyuan Chen, Jianwei Wang, Xiaobin Niu

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  24. Machine learning predictions of high-Curie-temperature materials

    Applied Physics Letters · 2023

    Joshua F. Belot, Valentin Taufour, Stefano Sanvito, Gus L. W. Hart

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  25. Graph neural networks with molecular segmentation for property prediction and structure–property relationship discovery

    Computers & Chemical Engineering · 2023

    Zhudan Chen, Dazi Li, Minghui Liu, Jun Liu

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  26. Properties prediction of composites based on machine learning models: A focus on statistical index approaches

    Materials Today Communications · 2023

    Barshan Dev, Md Ashikur Rahman, Md. Jahidul Islam, Md Zillur Rahman, Deju Zhu

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  27. Machine Learning Aided Design and Optimization of Thermal Metamaterials

    Chemical Reviews · 2024

    Changliang Zhu, Emmanuel Anuoluwa Bamidele, Xiangying Shen, Guimei Zhu, Baowen Li

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  28. Influence of feature-to-feature interactions on chloride migration in type-I cement concrete: A robust modeling approach using extra random forest

    Materials Today Communications · 2024

    Yassir M. Abbas, Abdulaziz S. Alsaif

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  29. Machine learning-based crack prediction modeling of laser cladding coatings

    Journal of Physics Conference Series · 2024

    Jiahuan Cui, Yanhui Zhang, Weiyan Lv

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  30. A review on machine learning-guided design of energy materials

    Progress in Energy · 2024

    Seongmin Kim, Jiaxin Xu, Wenjie Shang, Zhihao Xu, Eungkyu Lee, Tengfei Luo

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  31. Machine-learning synergy in high-entropy alloys: A review

    Journal of Materials Research and Technology · 2024

    Sally Elkatatny, Walaa Abd‐Elaziem, Tamer Ali Sebaey, Moustafa A. Darwish, Atef Saad Hamada

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  32. Deep Learning and Machine Learning for Materials Design

    IEEE International Symposium on Logistics and Industrial Informatics (LINDI) · 2024

    Mohammed Mudabbiruddin, Judit Takacs, Amir Hosein Mosavi, Felde Imre, Narjes Nabipour

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  33. Machine learning in advancing anode materials for Lithium-Ion batteries – A review

    Inorganic Chemistry Communications · 2024

    Mohammad Aminul Islam, Zahid Ahsan, Mustafizur Rahman, Md. Ibrahim Abdullah, Masud Rana, Nayem Hossain, Mohammad Assaduzzaman Chowdhury

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  34. Machine learning-based constitutive modelling for material non-linearity: A review

    Mechanics of Advanced Materials and Structures · 2024

    Arif Hussain, Amir Hosein Sakhaei, Mahmood Shafiee

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  35. Efficient prediction of potential energy surface and physical properties with Kolmogorov-Arnold Networks

    Journal of Materials Informatics · 2024

    Rui Wang, Hongyu Yu, Yang Zhong, Hongjun Xiang

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  36. Robust extreme gradient boosting model for predicting the behavior of RC slabs under impact loading: key influencing factors and performance insights

    Revista IBRACON de Estruturas e Materiais · 2025

    Ammar Babiker

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  37. Bibliometric analysis of artificial intelligence in high-to-room temperature superconductors: insights from the Scopus database

    Journal of Science and Technology Policy Management · 2025

    Andika Widya Pramono, Arif Nurhakim

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  38. High‐throughput calculation integrated with stacking ensemble machine learning for predicting elastic properties of refractory multi‐principal element alloys

    Materials Genome Engineering Advances · 2025

    Chengchen Jin, Kai Xiong, Congtao Luo, Hui Fang, Chaoguang Pu, Hua Dai, Aimin Zhang, Shunmeng Zhang, Yingwu Wang

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  39. Utilizing big data and categorical boosting modeling methodology to interpret the load-deflection behavior of steel fiber-reinforced concrete beams

    Engineering Applications of Artificial Intelligence · 2025

    Ahmet Tüken, Yassir M. Abbas, Nadeem A. Siddiqui

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  40. Recent advances in machine learning guided mechanical properties prediction and design of two-dimensional materials

    Thin-Walled Structures · 2025

    Runkai Liu, Runkai Liu, Shu Lin, Jing Wan, Le Li, Guoqiang Zhang, Huasong Qin, Yilun Liu

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  41. Intelligent screening model for uranium alloy corrosion substitute alloys based on machine learning

    Progress in Natural Science Materials International · 2025

    Wanying Zhang, Wanying Zhang, Xiaoyuan Wang, Yibo Ai, Weidong Zhang, Weidong Zhang

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  42. Enhancing design and behavioral understanding of steel fiber-reinforced concrete flat slabs through a robust machine learning framework

    Journal of Building Engineering · 2025

    Ammar Babiker, Yassir M. Abbas, M. Iqbal Khan, Radhouane Masmoudi

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  43. Integrating Materials Representations Into Feature Engineering in Machine Learning for Crystalline Materials: From Local to Global Chemistry‐Structure Information Coupling

    Wiley Interdisciplinary Reviews Computational Molecular Science · 2025

    Bin Xiao, Yuchao Tang, Yi Liu

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  44. Robust surrogate modeling for glass forming process

    The International Journal of Advanced Manufacturing Technology · 2025

    K. E. Chang, Aabhash Dhakal, Torsten Kraft

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  45. Optimizing the durability of cement-based systems through data-driven modeling and sensitivity analysis of chloride migration coefficients

    Journal of Engineering Research · 2025

    Yassir M. Abbas, M. Iqbal Khan

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  46. Differential Evolution-Enhanced Descriptor Selection for Low-Alloy Steel Performance Prediction

    Journal of Materials Engineering and Performance · 2025

    Siqian Liu, Guipeng Liu, Kehong Zhong, Juan Qi, Longwei Cheng, Dongmei Ai

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  47. Machine Learning‐Driven Perovskite Research from Experimental Exploration to Industrial Development

    Solar RRL · 2025

    Zhuo Feng, Xu Zhu, Meng Hao, Antai Yang, Jixin Tang, Chengquan Zhong, Kailong Hu, Jiakai Liu, Jingzi Zhang, Xi Lin

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  48. Engineering ZnS nanoarchitectures: Defects and dynamic surfaces for improved photocatalysis

    Journal of Molecular Structure · 2025

    Ashish Tiwari, Swati Bishnoi, Sanjay Janrao Dhoble

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  49. Accelerating the discovery and optimization of metal-organic framework materials via machine learning

    Advances in Colloid and Interface Science · 2025

    Hong Wang, Liang Yang, Deying Leng, Yanhai Du, Hao Ning

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  50. Machine learning-driven materials discovery: Unlocking next-generation functional materials – A review

    Computational Condensed Matter · 2025

    Dilshod Nematov, Mirabbos Hojamberdiev

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