Accelerating first-principles estimation of thermal conductivity by machine-learning interatomic potentials: A MTP/ShengBTE solution. - Bohayra Mortazavi; Evgeny V. Podryabinkin; Ivan S. Novikov; Timon Rabczuk; Xiaoying Zhuang; Alexander V. Shapeev (Comput. Phys. Commun., 2021)

The MLIP package: moment tensor potentials with MPI and active learning. - Ivan S. Novikov; Konstantin Gubaev; Evgeny V. Podryabinkin; Alexander V. Shapeev (Mach. Learn. Sci. Technol., 2021)