Grid Computing with Relativistic Quantum Chemistry Software - Case Study of Code Adaptation and Effective Deployment. - Miroslav Ilias; Miroslav Dobrucký (J. Grid Comput., 2014)

Generating and grading 34 optimised norm-conserving Vanderbilt pseudopotentials for actinides and super-heavy elements in the PseudoDojo. - Christian Tantardini; Miroslav Ilias; Matteo Giantomassi; Alexander G. Kvashnin; Valeria Pershina; Xavier Gonze (Comput. Phys. Commun., 2024)