Show 100 5 10 15 20 50 100 250 Sort by year (new to old) Actions Download search results Subscribe to news feed Your filters: cql: subject exact "Physics and Astronomy" cql: author exact 000060024711 or (type exact bookEditor and editor exact 000060024711) Add to list Journal Article A1 open access Acidity constant (pKa) calculation of large solvated dye molecules : evaluation of two advanced molecular dynamics methods Thierry De Meyer (UGent) , Bernd Ensing, Sven Rogge (UGent) , Karen De Clerck (UGent) , Evert Jan Meijer and Veronique Van Speybroeck (UGent) (2016) CHEMPHYSCHEM. 17(21). p.3447-3459 Add to list Journal Article A1 Exploring the vibrational fingerprint of the electronic excitation energy via molecular dynamics Andy Van Yperen-De Deyne (UGent) , Thierry De Meyer (UGent) , Ewald Pauwels (UGent) , An Ghysels (UGent) , Karen De Clerck (UGent) , Michel Waroquier (UGent) , Veronique Van Speybroeck (UGent) and Karen Hemelsoet (UGent) (2014) JOURNAL OF CHEMICAL PHYSICS. 140(13).