The adsorption of alkylmorpholine (DMP)on NaCl and KCl crystals was studied with the density functional theory (GGA-PW91)using computer simulation
where NaCl (100)with F color center and KCl (100)with O-2 defect.The charges of ions on NaCl(100)are changed to positive by F color center
while the charges of ions on KCl (100)are changed to negative by O-2.The adsorption energy of DMP on Na-top is -157.00 kJ·mol-1 and that on KCl (100)with O-2 is -59.14 kJ·mol-1.Therefore
DMP can be adsorbed on both NaCl and KCl
and the interaction between NaCl and DMP is stronger.The flotation experiments on the overflow potash ore containing alkylmorpholine indicate that the flotation recovery for NaCl is high
while the recovery of KCl is low.This result reflects different adsorption characteristics of DMP on surfaces of NaCl and KCl
which corroborates the result of computer simulation.