A ug 2 01 9 Thermal boundary resistance predictions with non-equilibrium Green ’ s function and molecular dynamics simulations

function and molecular dynamics simulations Yuanchen Chu, ∗) Jingjing Shi, ∗) Kai Miao, Yang Zhong, Prasad Sarangapani, Tim Fisher, Gerhard Klimeck, 4, 5 Xiulin Ruan, and Tillmann Kubis 4, 5, 6 1)School of Electrical and Computer Engineering, Purdue University, West Lafayette, IN 47907, USA 2)School of Mechanical Engineering, Purdue University, West Lafayette, IN 47907, USA 3)Department of Mechanical and Aerospace Engineering, University of California, Los Angeles, CA 90095, USA 4)Network for Computational Nanotechnology, Purdue University, West Lafayette, Indiana 47907, USA 5)Purdue Center for Predictive Materials and Devices, West Lafayette, Indiana 47907, USA 6)Purdue Institute of Inflammation, Immunology and Infectious Disease, West Lafayette, Indiana 47907, USA