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Autor:
Yu-ping Wang, Jian-jun Lu, Zhou Zhao, Jie Lian, Xing Wu, Chun-qi He, Xiu-ping Yue, Zhi-feng Yan
Publikováno v:
Journal of Fuel Chemistry and Technology. 49:1122-1131
The reaction mechanism of the isomerization of glucose to fructose and further dehydration of fructose to 5-hydroxymethylfurfural (5-HMF) in subcritical water was investigated by the dispersion-corrected density functional theory (DFT-D) method with