Welcome to the Donostia Kimika Teorikoa Group

Working since 1990, the Kimika Teorikoa Group at Donostia has established itself as a reference center in theoretical and computational chemistry. Initially led by Prof. Jesús M. Ugalde and currently co-led by Prof. Xabier Lopez, the group has been recognized as a consolidated research group by the Basque Government.

The team coordinates and participates in more than ten competitive research projects and collaborates internationally across multiple scientific domains.

The main research areas are summarized in the diagram shown on the right.

Pol-KT MatCat-KT Bio-KT NOF-KT MolEleS-KT QCDevelop-KT Sus-KT MoMag-KT
Pol-KT
Polymer Modeling Group
MatCat-KT
Materials Properties and Catalysis Group
Bio-KT
Theoretical Biochemistry Laboratory
NOF-KT
Natural Orbital Functional
MolEleS-KT
Molecular Electronic Structure
QCDevelop-KT
Quantum Chemistry Development
Sus-KT
Sustainable Chemistry Lab
MoMag-KT
Molecular Magnetism Lab