Computer-Chemie-Centrum (CCC)

The quest for a triplet ground-state alkene: Highly twisted C═C double bonds (2019) Wu JI, van Eikema Hommes N, Lenoir D, Bachrach SM Journal article What molecular dynamics simulations tell us about GPCRs (2019) Clark T, Ibrahim P Conference contribution Tuning electron transfer in supramolecular nano-architectures made of fullerenes and porphyrins (2019) Wang B, Bauroth S, Saha A, Chen M, Clark T, Lu X, Guldi DM Journal article The Feynman dispersion correction for MNDO extended to F, Cl, Br and I (2019) Kriebel M, Heßelmann A, Hennemann M, Clark T Journal article Interaction of Radicals with σ-Holes (2019) Clark T Journal article Varying the Interpentacene Electronic Coupling to Tune Singlet Fission (2019) Papadopoulos I, Zirzlmeier J, Hetzer C, Bae YJ, Krzyaniak MD, Wasielewski MR, Clark T, et al. Journal article Carbon Nanodots for Charge-Transfer Processes (2019) Margraf JT, Strauss V, Clark T, Guldi DM, Cadranel A Journal article Davydov splitting and singlet fission in excitonically coupled pentacene dimers (2019) Basel B, Hetzer C, Zirzlmeier J, Thiel D, Guldi R, Hampel F, Kahnt A, et al. Journal article Metadynamics simulations of ligand binding to GPCRs (2019) Ibrahim P, Clark T Journal article, Review article Pentacenes: A Molecular Ruler for Singlet Fission (2019) Basel B, Papadopoulos I, Thiel D, Casillas R, Zirzlmeier J, Clark T, Guldi DM, Tykwinski RR Journal article, Review article