Peverati, R. Advances in Theoretical Description of Molecules and their Environment : Density Functional Theory and Continuum Solvation Models. 2010, University of Zurich, Faculty of Science.
Peverati, R; Macrina, M; Baldridge, K K (2010). Assessment of DFT and DFT-D for potential energy surfaces of rare gas trimers - implementation and analysis of functionals and extrapolation procedures. Journal of Chemical Theory and Computation, 6(7):1951-1965.
Peverati, R; Baldridge, K K (2009). Implementation and optimization of DFT-D/COSab with respect to basis set and functional: Application to polar processes of furfural derivatives in solution. Journal of Chemical Theory and Computation, 5(10):2772-2786.
Peverati, R; Siegel, J S; Baldridge, K K (2009). Ab initio quantum chemical computations of substituent effects on triaziridine strain energy and heat of formation. Physical Chemistry Chemical Physics (PCCP), 11(14):2387-2395.
Peverati, R; Baldridge, K K (2008). Implementation and optimization of DFT-D with respect to basis set and functional for Study of Dispersion Interactions in Nanoscale Aromatic Hydrocarbons. Journal of Chemical Theory and Computation, 4(12):2030-2048.