Lila B Pandey et al.
The journal of physical chemistry. A, 117(4), 765-770 (2013-01-17)
Interaction of lactic acid with various sizes of magnesium oxide clusters (MgO)(x) (x = 2, 4, 6, 8, 9, 12, 15, 16, 18) is investigated. Density functional theory with the PBE functional and a polarized double-ζ basis set is employed