Spectral analysis of non-equilibrium molecular dynamics

By Tianli Feng, Yang Zhong, Divya Chalise, Xiulin Ruan

Extract the phonon modal temperature and heat flux from non-equilibrium molecular dynamics

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Version 1.0 - published on 01 Dec 2017

doi:10.4231/D3VH5CM12 cite this

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Cumulative Simulation Users

71

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Users By Organization Type
Type Users
Unidentified 64 (90.14%)
Educational - University 6 (8.45%)
Government Agency 1 (1.41%)
Users by Country of Residence
Country Users
us UNITED STATES 3 (42.86%)
kr KOREA, REPUBLIC OF 1 (14.29%)
cn CHINA 1 (14.29%)
hk HONG KONG 1 (14.29%)
fr FRANCE 1 (14.29%)

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Wall Clock Time 2.27 days 256.85 days
CPU time 1.03 days 116.83 days
Interaction Time 4.82 hours 22.71 days