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    Wettability alteration properties of fluorinated silica nanoparticles in liquid-loaded pores: An atomistic simulation

    , Article Applied Surface Science ; Volume 371 , 2016 , Pages 349-359 ; 01694332 (ISSN) Sepehrinia, K ; Mohammadi, A ; Sharif University of Technology
    Elsevier  2016
    Abstract
    Control over the wettability of reservoir rocks is of crucial importance for enhancing oil and gas recovery. In order to develop chemicals for controlling the wettability of reservoir rocks, we present a study of functionalized silica nanoparticles as candidates for wettability alteration and improved gas recovery applications. In this paper, properties of fluorinated silica nanoparticles were investigated in water or decane-loaded pores of mineral silica using molecular dynamics simulation. Trifluoromethyl groups as water and oil repellents were placed on the nanoparticles. Simulating a pore in the presence of trapped water or decane molecules leads to liquid bridging for both of the...