A transferable machine-learning framework linking interstice distribution and plastic heterogeneity in metallic glasses

by Qi Wang, Anubhav Jain
Published 2019

Optimal band structure for thermoelectrics with realistic scattering and bands

by Junsoo Park, Yi Xia, Vidvuds Ozoliņš, Anubhav Jain
Published 2021

When band convergence is not beneficial for thermoelectrics

by Junsoo Park, Maxwell Dylla, Yi Xia, Max Wood, G. Jeffrey Snyder, Anubhav Jain
Published 2021

Efficient calculation of carrier scattering rates from first principles

by Alex M. Ganose, Junsoo Park, Alireza Faghaninia, Rachel Woods-Robinson, Kristin A. Persson, Anubhav Jain
Published 2021

A framework for quantifying uncertainty in DFT energy corrections

by Amanda Wang, Ryan Kingsbury, Matthew McDermott, Matthew Horton, Anubhav Jain, Shyue Ping Ong, Shyam Dwaraknath, Kristin A. Persson
Published 2021

Effective mass and Fermi surface complexity factor from ab initio band structure calculations

by Zachary M. Gibbs, Francesco Ricci, Guodong Li, Hong Zhu, Kristin Persson, Gerbrand Ceder, Geoffroy Hautier, Anubhav Jain, G. Jeffrey Snyder
Published 2017