AIMD dataset for Hafnium dioxide

The AIMD dataset generated from a melt-quench ab initio molecular dynamics (AIMD) protocol for Hafnium dioxide (HfO2)

Data and Resources

Cite this as

Ganesh Sivaraman, Anand Narayanan Krishnamoorthy, Matthias Baur, Christian Holm, Marius Stan, Gábor Csányi, Chris Benmore, Álvaro Vázquez-Mayagoitia (2024). Dataset: AIMD dataset for Hafnium dioxide. https://doi.org/10.57702/krrturyn

DOI retrieved: December 17, 2024

Additional Info

Field Value
Created December 17, 2024
Last update December 17, 2024
Defined In https://doi.org/10.1038/s41524-020-00367-7
Author Ganesh Sivaraman
More Authors
Anand Narayanan Krishnamoorthy
Matthias Baur
Christian Holm
Marius Stan
Gábor Csányi
Chris Benmore
Álvaro Vázquez-Mayagoitia