Structural Evolution of High-Rank Coals during Coalification and Graphitization: X-ray Diffraction, Raman Spectroscopy, High-Resolution Transmission Electron Microscopy, and Reactive Force Field Molecular Dynamics Simulation Study

Shuai Zhang,Botao Song,Chenxi Cao,Hao Zhang,Qinfu Liu,Kuo Li,Brian J. Teppen

Structural Evolution of High-Rank Coals during Coalification and Graphitization: X-ray Diffraction, Raman Spectroscopy, High-Resolution Transmission Electron Microscopy, and Reactive Force Field Molecular Dynamics Simulation Study

2021

Shuai Zhang
Botao Song
Chenxi Cao
Hao Zhang
Qinfu Liu
Kuo Li
Brian J. Teppen

The structure of organic matter in anthracite samples of different ranks and coal-derived natural graphites was investigated using XRD, micro-Raman spectroscopy, and HRTEM to determine XRD and Rama...

Keywords:

Force field (physics)
Materials science
High-resolution transmission electron microscopy
Molecular dynamics
structural evolution
X-ray crystallography
Chemical physics
Raman spectroscopy

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