People

Group leader

Dr. Ctirad Červinka

Research fellow

Dr. Martin Klajmon

Graduate students

Ing. Petr Touš  |  Ab initio crystal structure prediction and cocrystal screening for molecular materials

Ing. Jan Ludík  |  Ab initio investigation of polymorphism of molecular crystals  

M.Sc. Reynaldo Geronia  |  Accurate modeling of non-covalent interactions of bulky conjugated molecules from fast ab initio calculations

Master students

Bc. Veronika Kostková  |  Molecular modeling of structure and interactions in non-ionic porous liquids 

Bc. Jáchym Pavliš  |  Alternative parametrization techniques for SAFT-type equations of state

Bc. Veronika Šritterová  |   Molecular modeling of structure and interactions in ionic porous liquids

Bachelor students

Vladislav Aulich  |  Molecular modeling of active pharmaceutical ingredients dispersed in polymer matrices   

Jan Bártík | Structure and electronic properties of organic semiconductors from first principles 

Alumni

Ing. Lucie Draslarová  |  BOSCH

Bc. Lukáš Jiřiště  |  n/a

Dr. Daniel Himr  |  Brno University of Technology

Bc. Matěj Pur  |  Hospodářské noviny

Junior Star Team as of January 2023

Group as of June 2022