This dataset collects the inputs and outputs of the calculations (Gaussian, ADF, NBO, QTAIM) discussed in the paper entitled "Does the bending of uranyl influence its spectroscopy and luminescence" by Hanna Oher, André Severo Pereira Gomes, David D. Schnaars, Richard E. Wilson and Valérie Vallet.
-
Notifications
You must be signed in to change notification settings - Fork 0
valerie-vallet/data-uranyl-bent-phen
This commit does not belong to any branch on this repository, and may belong to a fork outside of the repository.
Folders and files
| Name | Name | Last commit message | Last commit date | |
|---|---|---|---|---|
Repository files navigation
About
Data for uranyl-bent-phen paper
Resources
Stars
Watchers
Forks
Packages 0
No packages published