TY  - RPRT
TI  - VeloxChem: A Python-driven density-functional theory program for spectroscopy simulations in high-performance computing environments
AU  - Rinkevicius, Zilvinas
AU  - Li, Xin
AU  - Vahtras, Olav
AU  - Ahmadzadeh, Karan
AU  - Brand, Manuel
AU  - Ringholm, Magnus
AU  - List, Nanna Holmgaard
AU  - Scheurer, Maximilian
AU  - Scott, Mikael
AU  - Dreuw, Andreas
AU  - Norman, Patrick
PY  - 2019
DO  - 10.1002/wcms.1457
UR  - https://www.osti.gov/biblio/1591634
ID  - 1591634
ER  -