Olav Vahtras
Professor of Theoretical Chemistry at KTH Royal Institute of Technology, Stockholm, Sweden.
PhD in Quantum Chemistry 1992
MSc in Engineering Physics 1988
Research interest, method development in quantum chemistry. Coauthor of the Dalton Program package.
Involvement in the Python community as co-editor of Scipy Lecture Notes and instructor for Software Carpentry/Data Carpentry.
@olavvahtras
Homepage – Git*hub|lab – Institute / Company –KTH Royal Institute of Technology
Sessions
09-05
14:45
30min
VeloxChem: Python meets quantum chemistry and HPC
Olav Vahtras
A new and efficient Python/C++ modular library for real and complex response functions at the
level of Kohn-Sham density functional theory
Track 3 (Oteiza)