https://www.selleckchem.com/peptide/pmx-205.html
We perform first-principles molecular dynamics (FPMD) simulations together with a CI-NEB method to explore the structure, electrochemical properties and diffusion dynamics of a C2N monolayer saturated with various univalent, bivalent and trivalent metal ions. A characteristic irregular adsorption structure consisting of an inner coplanar layer at the large atomic pore and loosely bound outer layer is discovered for all six types of ions. The predicted specific capacities and mean open circuit voltages (OCVs) for them are 600 mA h g-1, an
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