Code snippets

Actions:

View dataDownload geometry
Files in This Item:
File  
opt-b3lyp-pople.comDownload
output.cmlDownload

Metadata:

Title: oxolinic_acid_CONF3_gas
Authors: Pulgar Rubio, Antonio
Issue Date: 3-Oct-2022
Publisher: Barcelona Supercomputing Center
Description: Gaussian set of calculations with B3LYP of oxolinic_acid CONF3 in gas
URI: https://iochem-bd.bsc.es/browse/handle/100/234249
Appears in Collections:A_Fungicide - DOI: 10.19061/iochem-bd-6-173



Please use this identifier to cite or link to this item: https://iochem-bd.bsc.es/browse/handle/100/234249

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