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Adsorption mechanism investigation of methylthioninium chloride dye onto some metal phosphates using Monte Carlo dynamic simulations and DFT calculations

Chemical EngineeringEngineeringPhysicochemical AnalysisSurface ChemistrySurface ScienceChemisorptionPhysical ChemistryComputational ChemistryAdsorptionChemistryMetal PhosphatesChemical KineticsSurface ReactivityMethylthioninium Chloride DyeAdsorption Mechanism Investigation