Structures and properties of ionic crystals and condensed phase ionic liquids predicted with the generalized energy-based fragmentation method

von Li, Yunzhi
Veröffentlicht in: Journal of computational chemistry (2022)

Time-dependent density functional theory study on the absorption spectrum of Coumarin 102 and its hydrogen-bonded complexes

von Zhao, Wenwei
Veröffentlicht in: Journal of computational chemistry (2011)