Code snippets

Actions:

View dataDownload geometry
Files in This Item:
File  
a-SiW12O40_4-_BP86_H2O_4Li.runDownload
output.cmlDownload

Metadata:

Title: alpha-_SiW12O40__4-_BP86_Water_TZP_Li
Authors: Jacobs, Jake
Issue Date: 30-Oct-2023
Publisher: University of Glasgow
Description: alpha-[SiW12O40]_4- POM in Water solvent with Li counter-cations, calculated using the BP86 functional and TZP basis set.
URI: https://iochem-bd.bsc.es/browse/handle/100/312976
Appears in Collections:POM_geometry_optimisations - DOI: 10.19061/iochem-bd-6-298



Please use this identifier to cite or link to this item: https://iochem-bd.bsc.es/browse/handle/100/312976

Item files in Browse  Creative Commons License
HTML5 resume (see conditions inside)Creative Commons License