Ionic diffusion and proton transfer of MgCl2 and CaCl2 aqueous solutions: an ab initio study under electric field
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DOI: 10.1080/08927022.2018.1513650
Abstract: ABSTRACT We report on a series of ab initio molecular dynamics simulations on MgCl and CaCl aqueous solutions subjected to the effect of static electric fields. The diffusion properties of the solvated cationic species have… read more here.
Keywords: ionic diffusion; field; aqueous solutions; diffusion proton ... See more keywords