Jan Řezáč

3 ta ish

Czech Academy of Sciences, Institute of Organic Chemistry and Biochemistry

1. DFTB+, a software package for efficient approximate density functional theory based atomistic simulations

   B. Hourahine, Bálint Aradi, Volker Blüm +36

   MaqolaOAOchiq kirish202015 iqtibos

   ABIABI:AkademIndex/2026.other.040029

2. Parameterization of the DFTB3 Method for Br, Ca, Cl, F, I, K, and Na in Organic and Biological Systems

   Maximilian Kubillus, Tomáš Kubař, Michael Gaus +2

   Maqola201410 iqtibos

   ABIABI:AkademIndex/2026.other.115741

3. Non-covalent interactions atlas benchmark data sets 4: σ-hole interactions

   Kristian Kříž, Jan Řezáč

   Maqola20223 iqtibos

   ABIABI:AkademIndex/2026.other.252478