Ogre datasets

Published: 13 April 2020| Version 1 | DOI: 10.17632/g7rd93z4f2.1
Contributors:
Shuyang Yang,
Manny 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

License