Search Results for author: Andrea Cepellotti

Found 2 papers, 1 papers with code

Anomalous thermoelectric transport phenomena from interband electron-phonon scattering

no code implementations11 Mar 2021 Natalya S. Fedorova, Andrea Cepellotti, Boris Kozinsky

The Seebeck coefficient and electrical conductivity are two critical quantities to optimize simultaneously in designing thermoelectric materials, and they are determined by the dynamics of carrier scattering.

Materials Science

Bayesian Force Fields from Active Learning for Simulation of Inter-Dimensional Transformation of Stanene

3 code implementations26 Aug 2020 Yu Xie, Jonathan Vandermause, Lixin Sun, Andrea Cepellotti, Boris Kozinsky

We present a way to dramatically accelerate Gaussian process models for interatomic force fields based on many-body kernels by mapping both forces and uncertainties onto functions of low-dimensional features.

Active Learning

Cannot find the paper you are looking for? You can Submit a new open access paper.