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Study on the Effect of Low Molecular Hydrocarbon Compounds on Coal Spontaneous Combustion

Chuanbo Cui,Hanzhong Deng,Cunbao Deng,Xiaobo Wang,Zhiqiang Song

SSRN Electronic Journal（2021）

Cited 16|Views1
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Abstract
•Pentane reacts with oxygen by breaking old chemical bonds and forming new chemical bonds.•Active sites of pentane are C1, C5, C8, C11 and C14 atoms.•Priority order is Path 6 > Path 5 > Path 1 > Path 3 > Path 7 > Path 4 > Path 2.
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Key words
Coal,Spontaneous combustion,Pentane,Quantum chemistry,Dynamics
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