4 papers
Impact of electron-phonon interaction on the electronic structure of interfaces between organic molecules and a MoS monolayer
Ignacio Gonzalez Oliva, Sebastian Tillack, Fabio Caruso +2
By means of first-principles calculations, we investigate the role of electron-phonon interaction in the electronic structure of hybrid interfaces, formed by MoS and monolayers…
Efficient and BSE calculations of heterostructures within an all-electron framework
Maximilian Schebek, Ignacio Gonzalez Oliva, Claudia Draxl
The combination of two-dimensional materials into heterostructures offers new opportunities for the design of optoelectronic devices with tunable properties. However, computing ele…
Zero-energy band observation in an interfacial chalcogen-organic network
Yichen Jin, Ignacio Gonzalez Oliva, Hibiki Orio +12
Structurally-defined molecule-based lattices such as covalent organic or metal-organic networks on substrates, have emerged as highly tunable, modular platforms for two-dimensional…
Hybrid Frenkel-Wannier excitons facilitate ultrafast energy transfer at a 2D-organic interface
Wiebke Bennecke, Ignacio Gonzalez Oliva, Jan Philipp Bange +13
Two-dimensional transition metal dichalcogenides (TMDs) and organic semiconductors (OSCs) have emerged as promising material platforms for next-generation optoelectronic devices. T…