Surface Solvation of Halogen Anions in Water Clusters: An ab initio Molecular Dynamics Study of the Cl-(H.sub.2./sub.O).sub.6./sub. Complex

TOBIAS, D. J., JUNGWIRTH, P., PARRINELLO, M. Surface Solvation of Halogen Anions in Water Clusters: An ab initio Molecular Dynamics Study of the Cl-(H₂O)₆ Complex. Journal of Chemical Physics. 2001, 114(16), 7036-7044. ISSN 0021-9606. E-ISSN 1089-7690.