Ogre datasets
Published: 13 April 2020| Version 1 | DOI: 10.17632/g7rd93z4f2.1
Contributors:
Shuyang Yang,
Imanuel Bier,
Wen Wen,
Jiawei Zhan,
Saeed Moayedpour,
Noa Marom
Description
This dataset contains the DFT calculation results of aspirin, tetracene and HMX surfaces.
Files
Institutions
Carnegie Mellon University College of Engineering
Categories
Computational Materials Science