ioChem-BD Browse module - Item page

Item metadata and files

Code snippets

Actions:

View dataDownload geometry
Files in This Item:
File Retrieve
77PD_t15_C0085_OptFreq.hessDownload
77PD_t15_C0085_OptFreq.inpDownload
output.cmlDownload

Metadata:

Title: /DFT/77PD 77PD_C0085
Authors: Hail, Mylena
Issue Date: 7-Oct-2026
Publisher: Barcelona Supercomputing Center
Abstract: DFT Opt+Freq calculation for the C0085 conformer
URI: https://iochem-bd.bsc.es/browse/handle/100/504965
Appears in Collections:DMS_UVPD_PPDs - DOI: 10.19061/iochem-bd-6-710



Please use this identifier to cite or link to this item: https://iochem-bd.bsc.es/browse/handle/100/504965

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