Understanding machine-learned density functionals (bibtex)
by Li Li, John C. Snyder, Isabelle M. Pelaschier, Jessica Huang, Uma-Naresh Niranjan, Paul Duncan, Matthias Rupp, Klaus-Robert Müller, Kieron Burke
Reference:
Understanding machine-learned density functionals Li Li, John C. Snyder, Isabelle M. Pelaschier, Jessica Huang, Uma-Naresh Niranjan, Paul Duncan, Matthias Rupp, Klaus-Robert Müller, Kieron Burke, International Journal of Quantum Chemistry 116, 819--833 (2016).
Bibtex Entry:
@article {LSPH14,
Pub-num = {153},
author = {Li, Li and Snyder, John C. and Pelaschier, Isabelle M. and Huang, Jessica and Niranjan, Uma-Naresh and Duncan, Paul and Rupp, Matthias and Müller, Klaus-Robert and Burke, Kieron},
title = {Understanding machine-learned density functionals},
journal = {International Journal of Quantum Chemistry},
volume = {116},
number = {11},
issn = {1097-461X},
url = {http://dx.doi.org/10.1002/qua.25040},
doi = {10.1002/qua.25040},
pages = {819--833},
keywords = {density functional theory, machine learning, orbital free, kinetic energy functional, self-consistent calculation, ML},
year = {2016},
}
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