60 citations · 117 across the 2 of their papers we have counts for
2 papers
physics.chem-ph2014★ 60 cited
Efficient Calculation of Electronic Absorption Spectra by Means of Intensity-Selected TD-DFTB
Robert Rüger, Erik van Lenthe, You Lu +3
During the last two decades density functional based linear response approaches have become the de facto standard for the calculation of optical properties of small and medium-size…
cond-mat.mtrl-sci2011★ 57 cited
Structure and electronic structure of Metal-Organic Frameworks within the Density-Functional based Tight-Binding method
Binit Lukose, Barbara Supronowicz, Petko St. Petkov +5
Density-functional based tight-binding is a powerful method to describe large molecules and materials. Metal-Organic Frameworks (MOFs), materials with interesting catalytic propert…