M. Mohseni
Department of Mining Engineering, Faculty of Engineering & Technology, Tarbiat Modares University, Tehran, Iran
[ 1 ] - An insight into effect of surface functional groups on reactivity of Sphalerite (110) surface with Xanthate collector: a DFT study
The reactivity of the protonated and hydroxylated sphalerite (1 1 0) surface with xanthate was simulated using the density functional theory (DFT). The difference between the energy of the lowest unoccupied molecular orbital of the sphalerite surface and the energy of the highest occupied molecular orbital of xanthate ( was used to compare the reaction capability of xanthate with fresh and fun...
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