1. Barcelona Supercomputing Center
  2. BSC host
  3. I_Fungicides

Code snippets

Actions:

View dataDownload geometry
Files in This Item:
File  
inpDownload
output.cmlDownload

Metadata:

Title: fthalide_CONF1_octanol
Authors: Pulgar Rubio, Antonio
Issue Date: 19-Jan-2023
Publisher: Barcelona Supercomputing Center
Description: ORCA wb97x-d3 def2-TZVPP single point calculation of fthalide CONF1 in octanol
URI: https://iochem-bd.bsc.es/browse/handle/100/267699
Appears in Collections:I_Fungicides - DOI: 10.19061/iochem-bd-6-202

Show full item record


Please use this identifier to cite or link to this item: https://iochem-bd.bsc.es/browse/handle/100/267699

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