Some of the research fronts pursued in our group

Publications of A. Lewis

Journal Article (1)

2021
Journal Article
Learning Electron Densities in the Condensed Phase
A. Lewis, A. Grisafi, M. Ceriotti, M. Rossi
Journal of Chemical Theory and Computation 17 (11), 7203–7214 (2021)

Working Paper (1)

2022
Working Paper
Electronic-structure properties from atom-centered predictions of the electron density
A. Grisafi, A. Lewis, M. Rossi, M. Ceriotti
(2022)

Other (1)

2021
Other
Overcoming barriers in nuclear dynamics with first principles electronic structure methods
M. Rossi, A. Akkoush, K. Fidanyan, M. Krynski, A. Lewis, Y. Litman, D. Maksimov, E. S. Pós, N. Raimbault, H. Wang
High Performance Computing and Data Science in the Max Planck Society (2021)
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