Fig. 12From: Experimental and theoretical study for removal of trimethoprim from wastewater using organically modified silica with pyrazole-3-carbaldehyde bridged to copper ionsa The size of the simulation box containing the modified silica surface and the vacuum layer, b MC poses of the lowest adsorption configurations for onto Modified silica surface and c MD lowest energy configurations of TMP molecule interaction onto Modified silica surfaceBack to article page