1. Barcelona Supercomputing Center
  2. BSC host
  3. High-Throughput Screening and Rational Design to Drive Discovery in Molecular Water Oxidation Catalysis

ioChem-BD Browse module - Item page

Item metadata and files

Code snippets

Actions:

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

Metadata:

Title: /beef_molsimps/Ru_3a1_19/OOH/LS INCAR
Authors: Craig, Michael
Issue Date: 19-Feb-2021
Publisher: Irish Centre for High-End Computing
CRANN
Barcelona Supercomputing Center
Trinity College Dublin
Description: high-throughput vasp, beef-vdw calculation submission
URI: https://iochem-bd.bsc.es/browse/handle/100/195475
Appears in Collections:High-Throughput Screening and Rational Design to Drive Discovery in Molecular Water Oxidation Catalysis - DOI: 10.19061/iochem-bd-6-81

Show full item record
Share Facebook Twitter Email


Please use this identifier to cite or link to this item: https://iochem-bd.bsc.es/browse/handle/100/195475

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