Title
Deep learning and self-consistent field theory: A path towards accelerating polymer phase discovery
Abstract
•A machine learning methodology is proposed to accelerate polymer SCFT simulations.•The deep learner is trained in Sobolev space.•The neural network is designed to be invariant under spatial shifts.•The Sobolev space-trained learners are used to accelerate saddle point finding.
Year
DOI
Venue
2021
10.1016/j.jcp.2021.110519
Journal of Computational Physics
Keywords
DocType
Volume
Self-consistent field theory,Machine learning,Sobolev space,Saddle density fields,Global shift-invariance
Journal
443
ISSN
Citations 
PageRank 
0021-9991
0
0.34
References 
Authors
0
4
Name
Order
Citations
PageRank
Xuan Yao142.12
Kris Delaney200.34
Hector Ceniceros300.34
Glenn Fredrickson400.34