MXene PHonon Database

MXenes are a family of two-dimensional materials composed of transition metal carbides, nitrides, or carbonitrides, derived from their bulk MAX phases. They exhibit metallic conductivity, tunable surface chemistry, and a layered structure—making them attractive for energy storage, electronics, and sensors. This database provides crystal structures and phonon dispersions of selected MXenes.

Select a chemical building block below or search directly for a compound:

Functional Groups

All MXene Compounds

Acknowledgments

• This work was performed at the Computational Materials Modeling for Innovative Technologies (COMMIT) Group, Department of Physics, University of Antwerp. This work is supported by the University of Antwerp and the Research Foundation – Flanders (FWO).
• The computational resources and services used in this work are provided by the VSC (Flemish Supercomputer Center), funded by the Research Foundation – Flanders (FWO) and the Flemish Government, Department of Economy, Science and Innovation (EWI).