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How to cite `CELL`¶

If you use CELL for your research, please cite it with:

CELL: a python package for cluster expansion with a focus on complex alloys

Santiago Rigamonti, Maria Troppenz, Martin Kuban, Axel Hübner, and Claudia Draxl

to be published

The following list provides an overview of publications that use CELL:

CELL: a Python package for cluster expansion with a focus on complex alloy

Santiago Rigamonti, Maria Troppenz, Martin Kuban, Axel Hübner, and Claudia Draxl

to be published

<references>
Predicting ground-state configurations and electronic properties of the thermoelectric clathrates Ba8AlxSi46-x and Sr8AlxSi46-x

M. Troppenz, S. Rigamonti, and C. Draxl

Chem. Mater. 29, 2414 (2017). arXiv, DOI, Journal cover, Data (NOMAD).
First-principles study of Pd-alloyed Cu(111) surface in hydrogen atmosphere at realistic temperatures

Z.-K. Han, D. Sarker, M. Troppenz, S. Rigamonti, C. Draxl, W. A. Saidi, and S. V. Levchenko

Journal of Applied Physics 128, 145302 (2020)

https://doi.org/10.1063/5.0020625
Partial Order-Disorder Transition Driving Closure of Band Gap: Example of Thermoelectric Clathrates

M. Troppenz, S. Rigamonti, J. O. Sofo, and C. Draxl

(2020)

https://arxiv.org/abs/2009.11137v1