QuanSheng Wu^1*, Christophe Piveteau², Zhida Song³, Oleg V. Yazyev¹

1 Institute of Physics, Ecole Polytechnique Fédérale de Lausanne (EPFL), CH-1015 Lausanne, Switzerland; National Centre for Computational Design and Discovery of Novel Materials MARVEL,Ecole Polytechnique Fédérale de Lausanne (EPFL), CH-1015 Lausanne, Switzerland

2 Institut für Theoretische Physik, ETH Zürich, 8093 Zürich, Switzerland

3 Beijing National Laboratory for Condensed Matter Physics, and Institute of Physics, Chinese Academy of Science, Beijing 100190, China

* Corresponding authors emails: wuquansheng@gmail.com

DOI10.24435/materialscloud:2019.0018/v1 [version v1]

Publication date: May 13, 2019

How to cite this record

QuanSheng Wu, Christophe Piveteau, Zhida Song, Oleg V. Yazyev, MgTa2N3: A reference Dirac semimetal, Materials Cloud Archive 2019.0018/v1 (2019), https://doi.org/10.24435/materialscloud:2019.0018/v1

Description

MgTa2N3 is predicted to host the topological Dirac semimetal phase. This archive includes input data necessary for reproducing first-principles calculation described in the publication.

Materials Cloud sections using this data

Files

File name	Size	Description
PhysRevB.98.081115-materialscloud-archive.tar.gz MD5md5:dd00ce471b58995271852e10bef4ecf4	6.6 KiB
README.txt MD5md5:e8358893f90ac38125b5da4b0e2aeae0	644 Bytes

License

Files and data are licensed under the terms of the following license: Creative Commons Attribution 4.0 International.
Metadata, except for email addresses, are licensed under the Creative Commons Attribution Share-Alike 4.0 International license.

External references

Keywords

MARVEL MgTa2N3 Dirac semimetal VASP WannierTools MARVEL/DD6 Topological materials Topological semimetal