Ogre datasets

Name: Ogre datasets
Creator: Shuyang Yang
Published: 2020-04-13T14:34:13.839Z
Keywords: Computational Materials Science

Published: 13-04-2020| 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.