1. Theory and Simulation of Materials (THEOS), and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), École Polytechnique Fédérale de Lausanne, 1015 Lausanne, Switzerland
2. Università degli studi di Milano Bicocca, Piazza dell’Ateneo Nuovo 1, 20126 Milano, Italy
3. Bicocca Quantum Technologies (BiQuTe) Centre, I-20126 Milano, Italy
4. Laboratory for Materials Simulations, Paul Scherrer Institut (PSI), 5232 Villigen, Switzerland