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Updated: May 24, 2026

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
10:52

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics

Published on: April 12, 2019

Estimation of the physicochemical properties of PCDD/Fs using three-dimensional holographic vector of atomic

Kun Xie1, Shu Qiao, Chuan Fu

  • 1College of Chemistry and Environmental Engineering, Chongqing Three Gorges University, Wanzhou, Chongqing, China.

Journal of Environmental Science and Health. Part A, Toxic/Hazardous Substances & Environmental Engineering
|March 16, 2012
PubMed

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