Johannes Kästner

Johannes Kästner

Universität Stuttgart - Stuttgart / Germany
Natural Sciences / Chemical Sciences
AD Scientific Index ID: 1787099
University of Stuttgart
person_outline Johannes Kästner's MOST POPULAR ARTICLES
1-) DL-FIND: an open-source geometry optimizer for atomistic simulations The journal of physical chemistry A 113 (43), 11856-11865, 2009
2-) Projector augmented wave method: ab initio molecular dynamics with full wave functions Bulletin of Materials Science 26 (1), 33-41, 2003
3-) C hem S hell—a modular software package for QM/MM simulations Wiley Interdisciplinary Reviews: Computational Molecular Science 4 (2), 101-110, 2014
4-) Bridging the gap between thermodynamic integration and umbrella sampling provides a novel analysis method:“Umbrella integration” The Journal of chemical physics 123 (14), 2005
5-) Bridging the gap between thermodynamic integration and umbrella sampling provides a novel analysis method:“Umbrella integration”J Kästner, W ThielThe Journal of chemical physics 123 (14), 20055202005