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Materials Science

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Physical Chemistry

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Polymer Science

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Theoretical and Computational Chemistry

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Dongyang Li

4 results in Authors: Dongyang Li

Theoretical and Computational Chemistry

Potential of Mean Force Calculation Using Non-Uniform Sampling Windows for Optimal Computational Efficiency

Naveen Kumar Vasudevan, Dongyang Li, Li Xi

Version 1 posted 18 July 2023

288

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Physical Chemistry

A Molecular Mechanism for Azeotrope Formation in Ethanol/benzene Binary Mixtures Through Gibbs Ensemble Monte Carlo Simulation

Dongyang Li, Ziqi Gao, Naveen Kumar Vasudevan, Hong Li, Xin Gao, Xingang Li, Li Xi

Version 1 posted 31 December 2019

862

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Materials Science

Rapid, Ambient Temperature Synthesis of Imine Covalent Organic Frameworks Catalyzed by Transition Metal Nitrates

Dongyang Zhu, Zhuqing Zhang, Muhammad M. Rahman, Yilin Li, Morgan Barnes, Safiya Khalil, Pulickel M. Ajayan, Rafael Verduzco

Version 1 posted 05 August 2020

956

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Polymer Science

Effects of molecular design parameters on plasticizer performance in poly(vinyl chloride): a comprehensive molecular simulation study

Dongyang Li, Kushal Panchal, Naveen Kumar Vasudevan, Roozbeh Mafi, Li Xi

Version 1 posted 18 August 2021

733

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