A comparison between quantum chemistry and quantum Monte Carlo techniques for the adsorption of water on the (001) LiH surface.

Tsatsoulis, Theodoros

A comparison between quantum chemistry and quantum Monte Carlo techniques for the adsorption of water on the (001) LiH surface. [electronic resource] - The Journal of chemical physics May 2017 - 204108 p. digital

Publication Type: Journal Article

1089-7690

10.1063/1.4984048 doi