Exploration, Sampling, And Reconstruction of Free Energy Surfaces with Gaussian Process Regression. (2016)
Attributed to:
TOUCAN: TOwards an Understanding of CAtalysis on Nanoalloys
funded by
EPSRC
Abstract
No abstract provided
Bibliographic Information
Digital Object Identifier: http://dx.doi.org/10.1021/acs.jctc.6b00553
PubMed Identifier: 27598684
Publication URI: http://europepmc.org/abstract/MED/27598684
Type: Journal Article/Review
Volume: 12
Parent Publication: Journal of chemical theory and computation
Issue: 10
ISSN: 1549-9618