1. Insights into structural and dynamical features of water at halloysite interfaces probed by DFT and classical molecular dynamics simulations. Issue 3 (22nd December 2015) Authors: Presti, Davide; Pedone, Alfonso; Mancini, Giordano; Duce, Celia; Tiné, Maria Rosaria; Barone, Vincenzo Journal: Physical chemistry chemical physics Issue: Volume 18:Issue 3(2016) Page Start: 2164 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. Modeling emission features of salicylidene aniline molecular crystals: A QM/QM' approach. Issue 9 (5th January 2016) Authors: Presti, Davide; Labat, Frédéric; Pedone, Alfonso; Frisch, Michael J.; Hratchian, Hrant P.; Ciofini, Ilaria; Cristina Menziani, Maria; Adamo, Carlo Journal: Journal of computational chemistry Issue: Volume 37:Issue 9(2016) Page Start: 861 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗