Papers citing Autonomous materials synthesis via hierarchical active learning of nonequilibrium phase diagrams
Active Learning for Rapid Targeted Synthesis of Compositionally Complex Alloys
Materials · 2024-08-14
Nathan Scott Johnson, Aashwin Mishra, Dylan J. Kirsch, Apurva Mehta
Read original paper ↗ ·Automation and Machine Learning for Accelerated Polymer Characterization and Development: Past, Potential, and a Path Forward
Macromolecules · 2024-09-07
Peter A. Beaucage, Duncan R. Sutherland, Tyler B. Martin
Read original paper ↗ ·Active learning assisted piezoelectric materials synthesis on the basis of composite decision-making
MedMat. · 2024-09-25
En Liang Zhao, Tingyu Wang, Yutong Wang, Zeng Fan, Ling Chen, Zhiyuan Zhu, Wei Tang
Read original paper ↗ ·Black-box optimization technique for investigation of surface phase diagram
AIP Advances · 2024-12-01
Makoto Urushihara, Kenji Yamaguchi, Ryo Tamura
Read original paper ↗ ·Polymorphous nature of the local structure of δ − B i 2 O 3
Physical Review Materials · 2024-12-26
Xingang Zhao, Oleksandr I. Malyi, Alex Zunger
Read original paper ↗ ·Autonomous Laboratories and Closed-Loop Materials Discovery: A Conceptual Framework for Self-Driving Experimentation
Journal of Computational and Data-Driven Materials Engineering · 2025-01-01
Thabo Nkosi, Lerato Molefe, Sipho Dlamini, Ayanda Mokoena, Kabelo Ndlovu
Read original paper ↗ ·Gaussian processes for dynamics learning in model predictive control
Annual Reviews in Control · 2025-01-01
Anna Scampicchio, Elena Arcari, Amon Lahr, Melanie N. Zeilinger
Read original paper ↗ ·Physics-informed Gaussian process classification for constraint-aware alloy design
Digital Discovery · 2025-01-01
Christofer Hardcastle, Ryan O'Mullan, Raymundo Arróyave, Brent Vela
Read original paper ↗ ·Resource Allocation without Deliberation: Governance Structures in Autonomous Materials Experimentation
Journal of Computational and Data-Driven Materials Engineering · 2025-01-01
Fatima Zahra Amrani, Youssef Benali
Read original paper ↗ ·Runaway Discovery Trajectories: Intervention Thresholds in Self-Reinforcing Materials AI Systems
Journal of Computational and Data-Driven Materials Engineering · 2025-01-01
Claire Martin, Julien Robert, Sophie Bernard
Read original paper ↗ ·The Problem of Negative Results in Materials AI: A Conceptual Proposal for Failure-Aware Learning Systems
Journal of Artificial Intelligence for Materials Science · 2025-01-01
Fatima Zahra Amrani, Youssef Benali
Read original paper ↗ ·Accelerating CALPHAD-based phase diagram predictions in complex alloys using universal machine learning potentials: Opportunities and challenges
Acta Materialia · 2025-01-22
Siya Zhu, Doğuhan Sarıtürk, Raymundo Arróyave
Read original paper ↗ ·Frequency transfer and inverse design for metasurface under multi-physics coupling by Euler latent dynamic and data-analytical regularizations
Nature Communications · 2025-03-06
Enze Zhu, Zheng Zong, Erji Li, Yang Lu, Jingwei Zhang, Hao Xie, Ying Li, Wen‐Yan Yin, Zhun Wei
Read original paper ↗ ·Laser‐Induced Crystallization and Oxidation Phase Diagrams for High‐Throughput Evaluation of MoS 2 /MoO x Optical Thin Films
Advanced Optical Materials · 2025-05-05
Drake Austin, Brian M. Everhart, Michael Altvater, Arthur R. Woll, Christopher Muratore, Benjamin Robertson, Lirong Sun, Mario Hofmann, Michael E. McConney, Peter R. Stevenson, Nicholas R. Glavin
Read original paper ↗ ·Probabilistic phase labeling and lattice refinement for autonomous materials research
npj Computational Materials · 2025-05-24
Ming-Chiang Chang, Sebastian Ament, Maximilian Amsler, Duncan R. Sutherland, Lan Zhou, John M. Gregoire, Carla Pedro Gomes, Robert Bruce Van Dover, Michael O. Thompson
Read original paper ↗ ·Artificial Intelligence‐Driven Approaches in Semiconductor Research
Advanced Materials · 2025-06-19
Yanping Zheng, Hao Xu, Zhexin Li, Linlin Li, Yongchao Yu, Pengfei Jiang, Yanmeng Shi, Jing Zhang, Yuqing Huang, Qing Luo, Zheng Lou, Lili Wang
Read original paper ↗ ·Machine Learning-Based High Entropy Alloys-Algorithms and Workflow: A Review
Acta Metallurgica Sinica (English Letters) · 2025-06-28
Hao Cheng, Chenglei Wang, Xiao-Du Li, Li Pan, Chaojie Liang, Weijie Liu
Read original paper ↗ ·Real-time experiment-theory closed-loop interaction for autonomous materials science
Science Advances · 2025-07-02
Haotong Liang, C Wang, Heshan Yu, Dylan J. Kirsch, Rohit Kumar Pant, Austin McDannald, Aaron Gilad Kusne, Ji‐Cheng Zhao, Ichiro Takeuchi
Read original paper ↗ ·Artificial Intelligence for Materials Discovery, Development, and Optimization
ACS Nano · 2025-07-25
Benediktus Madika, Aditi Saha, Chaeyul Kang, Batzorig Buyantogtokh, Joshua Agar, Chris M. Wolverton, Peter W. Voorhees, P. B. Littlewood, Sergei V. Kalinin, Seungbum Hong
Read original paper ↗ ·AutoSAS: A new human-aside-the-loop paradigm for automated SAS fitting for high throughput and autonomous experimentation
APL Machine Learning · 2025-08-12
Duncan R. Sutherland, Rachel R. Ford, Yun Liu, Tyler B. Martin, Peter A. Beaucage
Read original paper ↗ ·Bayesian Optimization for Multicomponent Supramolecular Systems
Journal of the American Chemical Society · 2025-09-04
Stef A. H. Jansen, Albert Jan Markvoort, Freek V. de Graaf, Martin G. T. A. Rutten, Patricia Y. W. Dankers, Ghislaine Vantomme, Tom F. A. de Greef, Egbert W. Meijer
Read original paper ↗ ·Benchmarking self-driving labs
Digital Discovery · 2025-10-09
Adedire D. Adesiji, Jiashuo Wang, Cheng-Shu Kuo, Keith A. Brown
Read original paper ↗ ·Building an affordable self-driving lab: Practical machine learning experiments for physics education using Internet-of-Things
APL Machine Learning · 2025-10-29
Yang Liu, Quan Lei, Xiaolong He, Yizhe Xue, Kexin He, Haitao Yang, Yong Wang, Xian Zhang, Li Yang, Yichun Zhou, Ruiqi Hu, Yong Jun Xie
Read original paper ↗ ·Dynamical mean field theory for real materials on a quantum computer
npj Computational Materials · 2025-10-31
Johannes Selisko, Maximilian Amsler, Christopher Wever, Yukio Kawashima, Ge. G. Samsonidze, Rukhsan Ul Haq, Francesco Tacchino, Ivano Tavernelli, Thomas Eckl
Read original paper ↗ ·PhaseXplorer Creates High-Dimensional Phase Diagrams with Closed-Loop Active Learning
ACS Nano · 2025-11-03
Stef A. H. Jansen, Lasse Sander Dreyer, Jule van Basten, Yihan Yao, Daniel E. Otzen, Tom F. A. de Greef, Tuomas P. J. Knowles, Egbert W. Meijer, Nadia A. Erkamp
Read original paper ↗ ·A self-driving physical vapor deposition system making sample-specific decisions on the fly
npj Computational Materials · 2025-11-05
Yu Zheng, Connor Blake, Layla Mravac, Fengxue Zhang, Yuxin Chen, Shuolong Yang
Read original paper ↗ ·Machine learning potentials for alloys: a detailed workflow to predict phase diagrams and benchmark accuracy
npj Computational Materials · 2025-11-19
Siya Zhu, Doğuhan Sarıtürk, Raymundo Arróyave
Read original paper ↗ ·Intelligent screening of porous materials: A review of active-learning approaches in MOF research
Chemical Physics Reviews · 2025-12-01
Etinosa Osaro, Yamil J. Colón
Read original paper ↗ ·Networking autonomous material exploration systems through transfer learning
npj Computational Materials · 2025-12-09
Naoki Yoshida, Yutaro Iwabuchi, Yasuhiko Igarashi, Yuma Iwasaki
Read original paper ↗ ·Role of the thermomagnetic coupling mechanism in phase-change materials for advanced applications
Discover Applied Sciences · 2025-12-24
Wubshet Getachew Mengesha
Read original paper ↗ ·Bayesian diversity control for batch-based phase diagram determination
Digital Discovery · 2026-01-01
Peiheng Zou, Ryo Tamura, Koji Tsuda
Read original paper ↗ ·Metallurgy-informed Bayesian optimization: rethinking alloy discovery and design
Digital Discovery · 2026-01-01
Raymundo Arróyave
Read original paper ↗ ·Review of module designs for organic and perovskite solar cells
Energy & Environmental Science · 2026-01-01
Jae Won Kim, You‐Hyun Seo, Hee Jeong Jeong, Eun Chong Chae, Helen Hejin Park, Bong Joo Kang, Kyungsik Kim, Jinho Lee, Soonil Hong, Nam Joong Jeon
Read original paper ↗ ·Instabilities and phase transitions in architected metamaterials: a gradient-enhanced continuum approach
Computer Methods in Applied Mechanics and Engineering · 2026-01-15
Sarvesh Joshi, S. Mohammad Mousavi, Craig M. Hamel, Stavros Gaitanaros, Prashant K. Purohit, Ryan Alberdi, Nikolaos Bouklas
Read original paper ↗ ·Predicting DNA Origami Stability in Physiological Media by Machine Learning
Small Structures · 2026-02-01
Judith Zubia-Aranburu, Andrea Gardin, Lars J. M. M. Paffen, Matteo Tollemeto, Ane Alberdi, Maite Termenón, Francesca Grisoni, Tania Patiño
Read original paper ↗ ·Machine Learning Toolkits and Frameworks for Materials Design
Wiley Interdisciplinary Reviews Computational Molecular Science · 2026-03-01
B. Moses Abraham, Yury G. Gogotsi
Read original paper ↗ ·Next-generation hydrogen storage: Artificial intelligence-powered optimization for clean energy
Next Energy · 2026-03-13
Manikandan Palanichamy
Read original paper ↗ ·Active Learning‐Guided Polymorph Control in Co‐Precipitation Synthesis
Small Methods · 2026-03-19
Tong Gang Zhao, Yan Zeng
Read original paper ↗ ·LLMs, RAG systems, and agents in crystalline materials discovery and characterization: A systematic review
MRS Bulletin · 2026-04-24
Joseph Oche Agada, Arpan Biswas
Read original paper ↗ ·Beyond Molecular Determinism: State‐Convergent Polymerization as a Functional Design Principle Under Chemical Complexity
Advanced Science · 2026-06-09
Seonki Hong
Read original paper ↗ ·Real-time Multi-instrument Autonomous Materials Screening for Discovery of Novel Phase-change Memory Materials
Research Square · 2026-06-24
Ichiro Takeuchi, Chih‐Yu Lee, Haotong Liang, Ryan Kim, Carlos Rı́os, Austin McDannald, Aaron Gilad Kusne
Read original paper ↗ ·Toward autonomous experimentation: Bayesian optimization over problem formulation space for accelerated alloy development
Materials & Design · 2026-07-15
Joseph Wagner, Danial Khatamsaz, Brent Vela, Raymundo Arróyave, Douglas Allaire
Read original paper ↗ ·Autonomous Materials Exploration Integrates Automated Phase Identification and AI Agents Enhanced by Human Guidance
PRX Intelligence · 2026-07-28
Ming-Chiang Chang, Maximilian Amsler, Duncan R. Sutherland, Sebastian Ament, Katie R. Gann, Lan Zhou, Louisa Smieska, Arthur R. Woll, John M. Gregoire, Carla P. Gomes, Robert Bruce Van Dover, Michael O. Thompson
Read original paper ↗ ·AI for Accelerated Materials Discovery: From Generative Design to Autonomous Realization
Chemical Reviews · 2026-08-03
Jiwoo Choi, Seongmin Kim, Junkil Park, Junyoung Choi, Sunggi An, Yousung Jung
Read original paper ↗ ·A review of autonomous experimentation in lignocellulosic bioethanol production: Self-driving laboratory strategies for process optimization
Chemical Engineering Journal Green and Sustainable · 2026-08-15
Karan Kapoor, Sudarshan Sahu, Saumya Bharti, Anupreet Kaur, Shailendra Kumar Arya
Read original paper ↗ ·Large-language-model-driven adaptive search space definition for autonomous closed-loop materials exploration
Communications Materials · 2026-08-25
Yuma Iwasaki, Ryo Toyama, Ryo Tamura, Shôichi Matsuda, Yuya Sakuraba, Masato Kotsugi, Yasuhiko Igarashi, Keitaro Sodeyama
Read original paper ↗ ·Autonomous Multi‐Objective Nanoscale Characterization of Combinatorial (Al, Sc, B)N Films Reveals Composition‐Dependent Ferroelectric Regimes
Advanced Functional Materials · 2026-09-10
Yu Liu, Aditya Raghavan, Utkarsh Pratiush, Ian Mercer, Pochun Hsieh, Albert Suceava, Chih‐Yu Lee, Edgar Dimitrov, Mauricio Terrones, Ichiro Takeuchi, Venkatraman Gopalan, Jon‐Paul Maria, Sergei V. Kalinin
Read original paper ↗ ·From Coprecipitation to Nanostructure: Formation, Morphology, and Reactive-Site Accessibility in Fe-Containing Binary Layered Double Hydroxides
Nanomaterials · 2026-09-24
Alua Alikeyeva, Nurbolat Kudaibergenov, Kairzhan Shalmagambetov, A.I. Azimbay
Read original paper ↗ ·