Published January 7, 2016
| Version v1
Dataset
Open
Computation-Ready Experimental Metal-Organic Framework (CoRE MOF) 2014 DDEC Database
Description
~2,900 structures CoRE MOF 2014 structures with DDEC partial atomic charges.
Notes
Yongchul G. Chung ([email protected]) maintains this particular dataset but was not involved in deriving the dataset.
Files
Files
(19.7 MB)
| Name | Size | Download all |
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md5:a2e3578003968739640b6faeed361299
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19.7 MB | Download |