skip to main content

DOE PAGESDOE PAGES

This content will become publicly available on August 22, 2019

Title: Hydrogen evolution reaction (HER) on Au@Ag ultrananoclusters as electro-catalysts

An atomistic view of hydronium (H 3 O + ) attachment to a subnanometer Ag 12 AuH 11 HER catalyst.
Authors:
ORCiD logo [1] ; ORCiD logo [1] ; ORCiD logo [2] ; ORCiD logo [2]
  1. Beijing Key Laboratory of Energy Environmental Catalysis, State Key Laboratory of Organic–Inorganic Composites, Beijing University of Chemical Technology, Beijing, China
  2. CNR-ICCOM & IPCF, Consiglio Nazionale delle Ricerche, Pisa, Italy
Publication Date:
Grant/Contract Number:
AC02-06CH11357
Type:
Publisher's Accepted Manuscript
Journal Name:
Nanoscale
Additional Journal Information:
Journal Name: Nanoscale Journal Volume: 10 Journal Issue: 37; Journal ID: ISSN 2040-3364
Publisher:
Royal Society of Chemistry (RSC)
Sponsoring Org:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Country of Publication:
United Kingdom
Language:
English
OSTI Identifier:
1470574

Chang, Le, Cheng, Daojian, Sementa, Luca, and Fortunelli, Alessandro. Hydrogen evolution reaction (HER) on Au@Ag ultrananoclusters as electro-catalysts. United Kingdom: N. p., Web. doi:10.1039/C8NR06105J.
Chang, Le, Cheng, Daojian, Sementa, Luca, & Fortunelli, Alessandro. Hydrogen evolution reaction (HER) on Au@Ag ultrananoclusters as electro-catalysts. United Kingdom. doi:10.1039/C8NR06105J.
Chang, Le, Cheng, Daojian, Sementa, Luca, and Fortunelli, Alessandro. 2018. "Hydrogen evolution reaction (HER) on Au@Ag ultrananoclusters as electro-catalysts". United Kingdom. doi:10.1039/C8NR06105J.
@article{osti_1470574,
title = {Hydrogen evolution reaction (HER) on Au@Ag ultrananoclusters as electro-catalysts},
author = {Chang, Le and Cheng, Daojian and Sementa, Luca and Fortunelli, Alessandro},
abstractNote = {An atomistic view of hydronium (H 3 O + ) attachment to a subnanometer Ag 12 AuH 11 − HER catalyst.},
doi = {10.1039/C8NR06105J},
journal = {Nanoscale},
number = 37,
volume = 10,
place = {United Kingdom},
year = {2018},
month = {1}
}

Works referenced in this record:

Generalized Gradient Approximation Made Simple
journal, October 1996
  • Perdew, John P.; Burke, Kieron; Ernzerhof, Matthias
  • Physical Review Letters, Vol. 77, Issue 18, p. 3865-3868
  • DOI: 10.1103/PhysRevLett.77.3865

Computational high-throughput screening of electrocatalytic materials for hydrogen evolution
journal, October 2006
  • Greeley, Jeff; Jaramillo, Thomas F.; Bonde, Jacob
  • Nature Materials, Vol. 5, Issue 11, p. 909-913
  • DOI: 10.1038/nmat1752

Powering the planet: Chemical challenges in solar energy utilization
journal, October 2006
  • Lewis, N. S.; Nocera, D. G.
  • Proceedings of the National Academy of Sciences, Vol. 103, Issue 43, p. 15729-15735
  • DOI: 10.1073/pnas.0603395103

Effect of the size-selective silver clusters on lithium peroxide morphology in lithium–oxygen batteries
journal, September 2014
  • Lu, Jun; Cheng, Lei; Lau, Kah Chun
  • Nature Communications, Vol. 5, Article No. 4895
  • DOI: 10.1038/ncomms5895

Solar Water Splitting Cells
journal, November 2010
  • Walter, Michael G.; Warren, Emily L.; McKone, James R.
  • Chemical Reviews, Vol. 110, Issue 11, p. 6446-6473
  • DOI: 10.1021/cr1002326

Recent advances in transition metal phosphide nanomaterials: synthesis and applications in hydrogen evolution reaction
journal, January 2016
  • Shi, Yanmei; Zhang, Bin
  • Chemical Society Reviews, Vol. 45, Issue 6, p. 1529-1541
  • DOI: 10.1039/C5CS00434A

A climbing image nudged elastic band method for finding saddle points and minimum energy paths
journal, December 2000
  • Henkelman, Graeme; Uberuaga, Blas P.; Jónsson, Hannes
  • The Journal of Chemical Physics, Vol. 113, Issue 22, p. 9901-9904
  • DOI: 10.1063/1.1329672

Semiempirical GGA-type density functional constructed with a long-range dispersion correction
journal, January 2006
  • Grimme, Stefan
  • Journal of Computational Chemistry, Vol. 27, Issue 15, p. 1787-1799
  • DOI: 10.1002/jcc.20495