Accurate Surface and Finite-Temperature Bulk Properties of Lithium Metal at Large Scales Using Machine Learning Interaction Potentials

• Mgcini Keith Phuthi,
• Archie Mingze Yao,
• Simon Batzner,
• Albert Musaelian,
• Pinwen Guan,
• Boris Kozinsky,
• Ekin Dogus Cubuk,
• Venkatasubramanian Viswanathan

Affiliations

Mgcini Keith Phuthi

Department of Mechanical Engineering, Carnegie Mellon University, Pittsburgh, Pennsylvania, United States

Archie Mingze Yao

Department of Mechanical Engineering, Carnegie Mellon University, Pittsburgh, Pennsylvania, United States

Simon Batzner

School of Engineering and Applied Science, Harvard University, Cambridge, Massachusetts, United States

Albert Musaelian

School of Engineering and Applied Science, Harvard University, Cambridge, Massachusetts, United States

Pinwen Guan

Department of Mechanical Engineering, Carnegie Mellon University, Pittsburgh, Pennsylvania, United States

Boris Kozinsky

School of Engineering and Applied Science, Harvard University, Cambridge, Massachusetts, United States

Ekin Dogus Cubuk

Google DeepMind, London, U.K.

Venkatasubramanian Viswanathan

Department of Mechanical Engineering, Carnegie Mellon University, Pittsburgh, Pennsylvania, United States