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The last 5 uploaded publications
A practical guide to machine learning interatomic potentials – Status and future
Ryan Jacobs, Dane Morgan, Siamak Attarian, Jun Meng, Chen Shen, Zhenghao Wu, Clare Yijia Xie, Julia H. Yang, Nongnuch Artrith, Ben Blaiszik, Gerbrand Ceder, Kamal Choudhary, Gábor Csányi, Ekin D. Cubuk, Bowen Deng, Ralf Drautz, Xiang Fu, Jonathan Godwin, Vasant Honavar, Olexandr Isayev, Anders Johansson, Boris Kozinsky, Stefano Martiniani, Igor Poltavsky, Igor Poltavsky, So Takamoto, Aidan P. Thompson, Aidan P. Thompson, Julia Westermayr, Boris Kozinsky (2025). A practical guide to machine learning interatomic potentials – Status and future. , 35, DOI: https://doi.org/10.1016/j.cossms.2025.101214.
Article14 days ago<i>Ab initio</i>study of short-range ordering in vanadium-based disordered rocksalt structures
Zinab Jadidi, Julia H. Yang, Tina Chen, Luis Barroso-Luque, Gerbrand Ceder (2023). <i>Ab initio</i>study of short-range ordering in vanadium-based disordered rocksalt structures. , 11(33), DOI: https://doi.org/10.1039/d3ta02475j.
Article14 days agoAb-initio study of short-range ordering in vanadium-based disordered rocksalt structures
Zinab Jadidi, Julia H. Yang, Tina Chen, Luis Barroso-Luque, Gerbrand Ceder (2023). Ab-initio study of short-range ordering in vanadium-based disordered rocksalt structures. , DOI: https://doi.org/10.48550/arxiv.2304.14645.
Preprint14 days agoCrystal Structures and Phase Stability of the Li<sub>2</sub>S–P<sub>2</sub>S<sub>5</sub>System from First Principles
Ronald L. Kam, KyuJung Jun, Luis Barroso-Luque, Julia H. Yang, Fengyu Xie, Gerbrand Ceder (2023). Crystal Structures and Phase Stability of the Li<sub>2</sub>S–P<sub>2</sub>S<sub>5</sub>System from First Principles. , 35(21), DOI: https://doi.org/10.1021/acs.chemmater.3c01793.
Article14 days agoCluster expansions of multicomponent ionic materials: Formalism and methodology
Luis Barroso-Luque, Peichen Zhong, Julia H. Yang, Fengyu Xie, Tina Chen, Bin Ouyang, Gerbrand Ceder (2022). Cluster expansions of multicomponent ionic materials: Formalism and methodology. , 106(14), DOI: https://doi.org/10.1103/physrevb.106.144202.
Article14 days ago