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Title: cation-heteroatom_distance_910pm_alpha-_W18O54(PO4)2__6-_BP86_Wa
Authors: Jacobs, Jake
Issue Date: 11-Aug-2024
Publisher: Barcelona Supercomputing Center
Description: alpha-[W18O54(PO4)2]_6- 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/100/327876
Appears in Collections:POM_geometry_optimisations_part2 - DOI: 10.19061/iochem-bd-6-395



Please use this identifier to cite or link to this item: https://iochem-bd.bsc.es/browse/handle/100/327876

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