Learning symmetry-preserving interatomic force fields for atomistic simulations

Thesis: S.M., Massachusetts Institute of Technology, Computation for Design and Optimization Program, 2019

Bibliographic Details
Main Author: Batzner, Simon Lutz.
Other Authors: Jeffrey C. Grossman and Boris Kozinsky.
Format: Thesis
Language:eng
Published: Massachusetts Institute of Technology 2019
Subjects:
Online Access:https://hdl.handle.net/1721.1/122525