Data for: Effects and correction of angular momentum non-conservation in RNEMD for calculating thermal conductivity

Published: 29 February 2020| Version 1 | DOI: 10.17632/433jx6h3mf.1
Contributors:
Bing-Yang Cao,
Hongao Yang

Description

This database contains data produced from simulations on graphene and silicon using original RNEMD and improved RNEMD. LAMMPS addtional source file for improved RNEMD and sample input files are provided.

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Institutions

Tsinghua University

Categories

Molecular Dynamics

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