3 papers
cond-mat.mtrl-sci2026
A sulfonitride transparent conductive thin film with ultra-high refractive index
Eugène Bertin, Shima Kadkhodazadeh, José María Castillo-Robles +9
With the rise of AI-assisted materials screening, extraordinary properties are now frequently predicted in experimentally uncharted material systems, highlighting the need to devel…
cond-mat.mtrl-sci2025
The Interoperability Challenge in DFT Workflows Across Implementations
S. K. Steensen, T. S. Thakur, M. Dillenz +11
Interoperability and cross-validation remains a significant challenge in the computational materials discovery community. In this context, we introduce a common input/output standa…
cond-mat.mtrl-sci2023
Oxide spinels with superior Mg conductivity
Mohsen Sotoudeh, Manuel Dillenz, Johannes Döhn +3
Mg batteries with oxide cathodes have the potential to significantly surpass existing Li-ion technologies in terms of sustainability, abundance, and energy density. However, Mg int…