Published January 18, 2023
| Version v1
Dataset
Open
Data Driven Discovery of MOFs for Hydrogen Gas Adsorption
Authors/Creators
- 1. Virginia Tech
Description
This data is in accordance with the submitted article to The Journal of Chemical Theory and Computation. This article is entitled, “Data Driven Discovery of MOFs for Hydrogen Gas Adsorption” by Samrendra K. Singh, Abhishek T. Sose, Fangxi Wang, Karteek K. Bejagam, and Sanket A. Deshmukh; to be published in the special issue on “Machine Learning for Molecular Simulation” in Journal of Chemical Theory and Computation.