James R Kermode

A preconditioning scheme for minimum energy path finding methods.

Christoph Ortner, Stela Makri, James R Kermode, 2019, The Journal of chemical physics.

Machine learning unifies the modeling of materials and molecules

Noam Bernstein, James R Kermode, Michele Ceriotti, 2017, Science Advances.

Sensitivity and dimensionality of atomic environment representations used for machine learning interatomic potentials.

Christoph Ortner, James R Kermode, Berk Onat, 2020, The Journal of chemical physics.