Ivano Tavernelli

Optimization of Effective Atom Centered Potentials for London Dispersion Forces in Density Functional Theory

O. Anatole von Lilienfeld, Ivano Tavernelli, Ursula Röthlisberger et al. · Physical Review Letters · 2004 · 520 citations

Engineering, Physics, Natural Sciences +13

Library of dispersion-corrected atom-centered potentials for generalized gradient approximation functionals: Elements H, C, N, O, He, Ne, Ar, and Kr

I‐Chun Lin, Maurı́cio D. Coutinho-Neto, Camille Felsenheimer et al. · Physical Review B · 2007 · 166 citations · Full text

Engineering, Computational Chemistry, Chemistry +19

Variational optimization of effective atom centered potentials for molecular properties

O. Anatole von Lilienfeld, Ivano Tavernelli, Ursula Röthlisberger et al. · The Journal of Chemical Physics · 2004 · 160 citations · Full text

Engineering, Computational Chemistry, Effective Atom +17

Performance of optimized atom-centered potentials for weakly bonded systems using density functional theory

O. Anatole von Lilienfeld, Ivano Tavernelli, Ursula Röthlisberger et al. · Physical Review B · 2005 · 112 citations · Full text

Molecular Solid, Engineering, Physics +14

Rhodopsin Absorption from First Principles: Bypassing Common Pitfalls

Ómar Valsson, Pablo Campomanes, Ivano Tavernelli et al. · Journal of Chemical Theory and Computation · 2013 · 92 citations · Full text

Excited State Property, Photoreceptor Cell, Biochemistry +11