QMOF Database
Version 15 2025-01-16, 13:52
Version 14 2021-12-09, 17:33
Version 13 2021-09-16, 07:04
Version 12 2021-09-15, 06:15
Version 11 2021-09-13, 05:02
Version 10 2021-09-02, 05:00
Version 9 2021-09-02, 04:01
Version 8 2021-07-13, 00:05
Version 7 2021-06-08, 02:28
Version 6 2021-05-07, 21:26
Version 5 2021-02-13, 05:59
Version 4 2021-01-12, 19:07
Version 3 2020-12-24, 18:04
Version 2 2020-12-05, 20:34
Version 1 2020-10-29, 17:33
dataset
posted on 2020-10-29, 17:33 authored by Andrew RosenAndrew Rosen, Shaelyn Iyer, Debmalya Ray, Zhenpeng Yao, Alan Aspuru-Guzik, Laura Gagliardi, Justin Notestein, Randall Q. SnurrThis repository hosts the Quantum MOF (QMOF) database – a dataset of quantum-chemical properties for over 14,000 metal–organic framework structures.
Please refer to the following GitHub repository for a description of the files hosted here, supplemental files/scripts, and other related information: https://github.com/arosen93/QMOF.
The pre-print corresponding to this work can be found at: https://doi.org/10.26434/chemrxiv.13147616.
