On Local Structure Equilibration of Ca2+ in Solution by Ab Initio Molecular Dynamics - Moison, Hugo; Aufort, Julie; Benoit, Magali; Méheut, Merlin (The journal of physical chemistry. B, 2024)
Keywords: B: Liquids; Chemical and Dynamical Processes in Solution; calcium; climate; fractionation; liquids; molecular dynamics; nutrient improvement; temperature; uncertainty