Molecular dynamics simulations of Zhundong coal pyrolysis using reactive force field von Hong, Dikun, Guo, Xin

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A comprehensive understanding of the synergistic effect during co-pyrolysis of polyvinyl chloride (PVC) and coal von Hong, Dikun, Gao, Peng, Wang, Chunbo

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ReaxFF simulations of the synergistic effect mechanisms during co-pyrolysis of coal and polyethylene/polystyrene von Hong, Dikun, Li, Ping, Si, Ting, Guo, Xin

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A reactive molecular dynamics study of HCN oxidation during pressurized oxy-fuel combustion von Hong, Dikun, Guo, Xin, Wang, Chunbo

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Construction of a coal char model and its combustion and gasification characteristics: Molecular dynamic simulations based on ReaxFF von Hong, Dikun, Liu, Liang, Wang, Chunbo, Si, Ting, Guo, Xin

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A reactive molecular dynamics study of CH4 combustion in O2/CO2/H2O environments von Hong, Dikun, Guo, Xin

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Effect of calcium on the secondary reactions of tar from Zhundong coal pyrolysis: A molecular dynamics simulation using ReaxFF von Hong, Dikun, Cao, Zheng, Guo, Xin

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Insight into the calcium carboxylate release behavior during Zhundong coal pyrolysis and combustion von Hong, Dikun, Si, Ting, Guo, Xin

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Programmable heating and quenching for enhancing coal pyrolysis tar yield: A ReaxFF molecular dynamics study von Xu, Tong, Wang, Chunbo, Hong, Dikun

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The Influence of NH3 on Coal Combustion Kinetics during Coal/NH3 Cocombustion: Experiments and ReaxFF MD Simulations von Hong, Dikun, Yuan, Lin, Wang, Chunbo

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The synergistic effect during co-combustion of municipal sludge and coal: Experimental and ReaxFF molecular dynamic study von Xu, Tong, Wang, Chunbo, Hong, Dikun, Li, Song, Yue, Shuang

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The Influence of NH 3 on Coal Combustion Kinetics during Coal/NH 3 Cocombustion: Experiments and ReaxFF MD Simulations von Hong, Dikun, Yuan, Lin, Wang, Chunbo

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High purity H2 production from sorption enhanced bio-ethanol reforming via sol-gel-derived Ni–CaO–Al2O3 bi-functional materials von Liu, Liang, Hong, Dikun, Wang, Nana, Guo, Xin

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High purity H-2 production from sorption enhanced bio-ethanol reforming via sol-gel-derived Ni-CaO-Al2O3 bi-functional materials von Liu, Liang, Hong, Dikun, Wang, Nana, Guo, Xin

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Coal/NH3 interactions during co-pyrolysis and their effects on the char reactivity for NO-reduction: A ReaxFF MD study von Hong, Dikun, Guo, Yajing, Wang, Chunbo, Wei, Riguang

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Experimental and ReaxFF molecular dynamic study of NO emission during municipal sludge/coal co-combustion von Xu, Tong, Wang, Chunbo, Hong, Dikun, Li, Song

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A ReaxFF study of the effect of pressure on the contribution of char-CO2 gasification to char conversion during pressurized oxy-fuel combustion von Hong, Dikun, Wang, Yanda, Zhai, Xiaoming

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Characterization of nitrogen and sulfur migration during pressurized coal pyrolysis and oxy-fuel combustion von Lei, Ming, Zhang, Yanchao, Hong, Dikun, Ye, Bin

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Competition between NH3-O2 reaction and char-O2 reaction and its influence on NO generation and reduction during char/NH3 co-combustion: Reactive molecular dynamic simulations von Hong, Dikun, Yuan, Lin, Wang, Chunbo

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Insight into CaO addition on coking resistance of Ni surface for sorption enhanced methane steam reforming: A density functional study von Liu, Liang, Hong, Dikun, Guo, Xin

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