1. Barcelona Supercomputing Center
  2. BSC host
  3. Universal Scaling Relationships for the Rational Design of Molecular Water Oxidation Catalysts with Near-Zero Overpotential

ioChem-BD Browse module - Item page

Item metadata and files

Code snippets

Actions:

View dataDownload geometry
Files in This Item:
File Retrieve
dispersion_tpssh-Ru-35-O4-LSb-dispf-disp.comDownload
output.cmlDownload
Referenced by:

Manuscript title: Universal scaling relations for the rational design of molecular water oxidation catalysts with near-zero overpotential

Journal: Nat. Commun.

DOI: 10.1038/s41467-019-12994-w

Metadata:

Title: /dispersion/Ru_3/Eo4 dispersion_Ru-3-O4-dispf-disp
Authors: Craig, Michael
Keywords: Density functional calculations
High-throughput screening
Water splitting
Issue Date: 1-Jul-2019
Publisher: Barcelona Supercomputing Center
Description: Calculation for oxo4 intermediate
URI: https://iochem-bd.bsc.es/browse/handle/100/193833
Appears in Collections:Universal Scaling Relationships for the Rational Design of Molecular Water Oxidation Catalysts with Near-Zero Overpotential - DOI: 10.19061/iochem-bd-6-15

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/100/193833

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