Sneha Akhade

Dr. Sneha Akhade

orcid

Research Focus & Metrics

Academic Career Length

16Years (2011-Present)

(Calculated once Scilit publication data is synced: current year − year of first publication + 1)

Representative Publications

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17 September 2020 in Chemical Reviews
Verified
Journal Article
Closed access
SASneha Akhade
Sneha Akhade
NSNirala Singh
Nirala Singh
Oliver GutierrezOliver Gutierrez
Oliver Gutierrez
Juan Lopez-RuizJuan Lopez-Ruiz
Juan Lopez-Ruiz
HWHuamin Wang
Huamin Wang
Vassiliki-Alexandra GlezakouVassiliki-Alexandra Glezakou
Vassiliki-Alexandra Glezakou

19 September 2019 in ACS Catalysis
Verified
Journal Article
Closed access
Juan Lopez-RuizJuan Lopez-Ruiz
Juan Lopez-Ruiz
EAEvan M. Andrews
Evan M. Andrews
SASneha Akhade
Sneha Akhade
MLMal-Soon Lee
Mal-Soon Lee
KKKatherine Koh
Katherine Koh
Jamie HolladayJamie Holladay
Jamie Holladay

8 March 2016 in Journal of the Electrochemical Society
Verified
Journal Article
Closed access
PDF file
SASneha Akhade
Sneha Akhade
IMIan T. McCrum
Ian T. McCrum
MJMichael J. Janik
Michael J. Janik
Electrolytic ions are known to impact the rates of electrocatalytic reactions, though a molecular understanding of the mechanism of such impact is not well understood. We employ density functional theory to investigate the specific adsorption of potassium and iodine ions on Cu (111), Cu (100) and Cu (211) electrode surfaces under CO2 electroreduction (CO2 ER) conditions and explore their effect on the reaction energetics and binding strength of reaction intermediates. The calculated equilibrium potentials for K* and I* adsorption (* denotes surface-adsorbed species) suggest that a low coverage of adsorbed K* and/or I* is thermodynamically favorable, at different pH, at CO2 ER overpotentials. Co-adsorbed I* serves to primarily weaken CO* binding and may promote CO* desorption or subsequent formation of C-H bonds, phenomena that are typically obstructed by a high surface coverage of CO*. Co-adsorbed K* preferentially increases the binding strength of O-terminated species, including CO* and CHO* relative to COH*. The presence of K* will shift the selectivity and kinetics of CO* reduction towards the CHO* pathway by destabilizing the COH* formation transition state. The impact of solvation in conjunction with the effects of ion specific adsorption on the energetics of CO* reduction are also discussed.

17 December 2020 in ACS Materials Letters
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Journal Article
Closed access
SWShanwen Wang
Shanwen Wang
Tianyi KouTianyi Kou
Tianyi Kou
JVJoel B. Varley
Joel B. Varley
SASneha Akhade
Sneha Akhade
SWStephen E. Weitzner
Stephen E. Weitzner
Yat LiYat Li
Yat Li

1 June 2017 in Catalysis Today
Verified
Journal Article
Closed access
SASneha Akhade
Sneha Akhade
NBNicole J. Bernstein
Nicole J. Bernstein
MEMonica R. Esopi
Monica R. Esopi
MRMichael J. Regula
Michael J. Regula
MJMichael J. Janik
Michael J. Janik

1 August 2015 in Electrochimica Acta
Verified
Journal Article
Closed access
IMIan T. McCrum
Ian T. McCrum
SASneha Akhade
Sneha Akhade
MJMichael J. Janik
Michael J. Janik