Bohayra Mortazavi, Evgeny V. Podryabinkin, Ivan S. Novikov, Timon Rabczuk, Xiaoying Zhuang, Alexander V. Shapeev. Accelerating first-principles estimation of thermal conductivity by machine-learning interatomic potentials: A MTP/ShengBTE solution. Computer Physics Communications, 258:107583, 2021. [doi]
@article{MortazaviPNRZS21,
title = {Accelerating first-principles estimation of thermal conductivity by machine-learning interatomic potentials: A MTP/ShengBTE solution},
author = {Bohayra Mortazavi and Evgeny V. Podryabinkin and Ivan S. Novikov and Timon Rabczuk and Xiaoying Zhuang and Alexander V. Shapeev},
year = {2021},
doi = {10.1016/j.cpc.2020.107583},
url = {https://doi.org/10.1016/j.cpc.2020.107583},
researchr = {https://researchr.org/publication/MortazaviPNRZS21},
cites = {0},
citedby = {0},
journal = {Computer Physics Communications},
volume = {258},
pages = {107583},
}