There is a newer version of this record available.

Dataset Open Access

Dataset and scripts for A Deep Dive into Machine Learning Density Functional Theory for Materials Science and Chemistry

Fiedler, Lenz; Shah, Karan; Cangi, Attila; Bussmann, Michael

BibTeX Export

@misc{fiedler_lenz_2021_1197,
  author       = {Fiedler, Lenz and
                  Shah, Karan and
                  Cangi, Attila and
                  Bussmann, Michael},
  title        = {{Dataset and scripts for A Deep Dive into Machine 
                   Learning Density Functional Theory for Materials
                   Science and Chemistry}},
  month        = oct,
  year         = 2021,
  doi          = {10.14278/rodare.1197},
  url          = {https://doi.org/10.14278/rodare.1197}
}
1,770
506
views
downloads
All versions This version
Views 1,770918
Downloads 506271
Data volume 625.3 MB296.6 MB
Unique views 865494
Unique downloads 10467
More info on how stats are collected.
Publication date:
October 1, 2021
DOI:
10.14278/rodare.1197

RODARE DOI Badge

DOI 

10.14278/rodare.1197

Markdown 

[![DOI](https://rodare.hzdr.de/badge/DOI/10.14278/rodare.1197.svg)](https://doi.org/10.14278/rodare.1197)

reStructedText 

.. image:: https://rodare.hzdr.de/badge/DOI/10.14278/rodare.1197.svg
   :target: https://doi.org/10.14278/rodare.1197

HTML 

<a href="https://doi.org/10.14278/rodare.1197"><img src="https://rodare.hzdr.de/badge/DOI/10.14278/rodare.1197.svg" alt="DOI"></a>

Image URL 

https://rodare.hzdr.de/badge/DOI/10.14278/rodare.1197.svg

Target URL 

https://doi.org/10.14278/rodare.1197

Related identifiers:
Identical to:
https://www.hzdr.de/publications/Publ-33194
Communities:
License (for files):
Creative Commons Attribution 4.0 International

Versions

Version v1.1.0 10.14278/rodare.1294 Oct 1, 2021
Version v1.0.0 10.14278/rodare.1197 Oct 1, 2021
Cite all versions? You can cite all versions by using the DOI 10.14278/rodare.1196. This DOI represents all versions, and will always resolve to the latest one. Read more.

Share

Cite as

Fiedler, Lenz, Shah, Karan, Cangi, Attila, & Bussmann, Michael. (2021). Dataset and scripts for A Deep Dive into Machine Learning Density Functional Theory for Materials Science and Chemistry (Version v1.0.0) [Data set]. Rodare. http://doi.org/10.14278/rodare.1197
Loading...

Export