Code snippets

Actions:

View dataDownload geometry
Files in This Item:
File  
m06l_pha_ts1a.comDownload
output.cmlDownload

Metadata:

Title: /M06L_BS1_optimized_structures m06l_pha_ts1a
Authors: G. Algarra, Andrés
Keywords: Reaction mechanisms
DFT benchmarking
3+2 cycloaddition
Cluster compounds
Alkynes
Issue Date: 22-Mar-2020
Publisher: Universitat de Barcelona
Universidad de Cádiz
Universitat Jaume I
Description: TS with PhA
URI: https://iochem-bd.bsc.es/browse/handle/100/194291
Appears in Collections:Mo3S4_benchmark_2020 - DOI: 10.19061/iochem-bd-6-34



Please use this identifier to cite or link to this item: https://iochem-bd.bsc.es/browse/handle/100/194291

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