Referenced by:
Manuscript title: Performance of Density Functionals and Semiempirical 3c Methods for Small Gold-Thiolate Clusters
Journal: J. Phys. Chem. A
Metadata:
Title: | supporting_material |
Authors: | Khatun, Maya |
Issue Date: | 18-Feb-2023 |
Publisher: | Barcelona Supercomputing Center |
Description: | sample orca input and output file, dataset, csv bond length and energy property |
URI: | https://iochem-bd.bsc.es/browse/handle/100/275455 |
Appears in Collections: | ausr - DOI: 10.19061/iochem-bd-6-212 |
Please use this identifier to cite or link to this item:
https://iochem-bd.bsc.es/browse/handle/100/275455