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Mineral Processing
An insight into effect of surface functional groups on reactivity of Sphalerite (110) surface with Xanthate collector: a DFT study

M. Mohseni; M. Abdollahy; R. Poursalehi; M. R. Khalesi

Volume 9, Issue 2 , April 2018, , Pages 431-439

http://dx.doi.org/10.22044/jme.2017.5965.1411

Abstract
  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 ...  Read More