3 citations · 3 across the 2 of their papers we have counts for
2 papers
physics.chem-ph2025
Performance of Automatic Active Space Selection for Electronic Excitation Energies
Reza G. Shirazi, Alexander Zech, Peter Pinski +1
Computation of electronic spectra is one of the most important applications of methods capturing static electron correlation, including complete-active-space self-consistent field…
cs.DB2021★ 3 cited
CateCom: a practical data-centric approach to categorization of computational models
Alexander Zech, Timur Bazhirov
The advent of data-driven science in the 21st century brought about the need for well-organized structured data and associated infrastructure able to facilitate the applications of…