77 citations · 715 across the 63 of their papers we have counts for
5 papers · 1 filter
Electronic Structure and Core Spectroscopy of Scandium Fluoride Polymorphs
Fabiana Machado Ferreira De Araujo, Daniel Duarte-Ruiz, Holger-Dietrich Saßnick +3
The microscopic knowledge of the structural, energetic, and electronic properties of scandium fluoride is still incomplete, despite the relevance of this material as an intermediat…
Modeling the electronic structure of organic materials: A solid-state physicist's perspective
Caterina Cocchi, Michele Guerrini, Jannis Krumland +2
Modeling the electronic and optical properties of organic semiconductors remains a challenge for theory, despite the remarkable progress achieved in the last three decades. The com…
Stability and electronic properties of CsKSb surface facets
Richard Schier, Holger-Dietrich Sassnick, Caterina Cocchi
First-principles methods have recently established themselves in the field of photocathode research to provide microscopic, quantum-mechanical characterization of relevant material…
Donors, Acceptors, and a Bit of Aromatics: Electronic Interactions of Molecular Adsorbates on hBN and MoS Monolayers
Giacomo Melani, Juan Pablo Guerrero-Felipe, Ana M. Valencia +3
The design of low-dimensional organic-inorganic interfaces for the next generation of opto-electronic applications requires an in-depth understanding of the microscopic mechanisms…
Laser-Controlled Charge Transfer in a Two-Dimensional Organic/Inorganic Optical Coherent Nanojunction
Matheus Jacobs, Jannis Krumland, Caterina Cocchi
Understanding the fundamental mechanisms ruling laser-induced coherent charge transfer in hybrid organic/inorganic interfaces is of paramount importance to exploit these systems in…