Machine learning transferable physics-based force fields using graph convolutional neural networks

Thesis: S.M., Massachusetts Institute of Technology, Department of Materials Science and Engineering, 2020

Bibliographic Details
Main Author: Harris, William H.(William Hunt)
Other Authors: Rafael Gomez-Bombarelli.
Format: Thesis
Language:eng
Published: Massachusetts Institute of Technology 2021
Subjects:
Online Access:https://hdl.handle.net/1721.1/128979