The diffusion behavior and capacitance of tetraethylammonium/tetrafluoroborate ions in acetonitrile with different molar concentrations: a molecular dynamics study
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DOI: 10.1039/c7ra09465e
Abstract: A molecular dynamics (MD) simulation with the optimized potentials for liquid simulations-all atom (OPLS-AA) force field was carried out to investigate the dynamic behaviors of organic electrolyte molecules between a graphite cathode and anode. This… read more here.
Keywords: diffusion behavior; tetrafluoroborate; molecular dynamics; net4 bf4 ... See more keywords