John A. Keith

Cited by

	All	Since 2018
Citations	5244	3072
h-index	40	33
i10-index	64	54

720

360

180

540

200820092010201120122013201420152016201720182019202020212022202318 38 44 78 146 224 317 413 419 436 492 490 579 715 697 98

Public access

View all

34 articles

7 articles

available

not available

Based on funding mandates

Co-authors

Emily A. CarterSenior Strategic Advisor for Sustainability Science, PPPL and Gerhard R. Andlinger Professor inVerified email at princeton.edu
Karthikeyan SaravananUniversity of PittsburghVerified email at pitt.edu
Yasemin BasdoganPostdoctoral Researcher, CaltechVerified email at caltech.edu
Michele PavoneAssociate Professor of Physical Chemistry - Department of Chemical Sciences, University of NaplesVerified email at unina.it
William A GoddardProfessor Chemistry, Materials Science, Applied PhysicsVerified email at caltech.edu
Ana Belén Muñoz-GarcíaAssociate Professor, Department of Physics, University of Naples Federico IIVerified email at unina.it
Charles D. GriegoPh.D. Student, University of PittsburghVerified email at pitt.edu
Andrew RitzmannPacific Northwest National LaboratoryVerified email at pnnl.gov
Kyle A. GriceAssociate Professor of Inorganic Chemistry, DePaul UniversityVerified email at depaul.edu
Alex M. MaldonadoPh.D. Candidate, University of PittsburghVerified email at pitt.edu
Robert J. NielsenUniversity of California IrvineVerified email at uci.edu
John KitchinCarnegie Mellon UniversityVerified email at andrew.cmu.edu
Brian StoltzProfessor of Chemistry, California Institute of TechnologyVerified email at caltech.edu
Peilin LiaoPurdue UniversityVerified email at purdue.edu
Valentin Vassilev-GalindoIMDEA Materials InstituteVerified email at imdea.org
Alexandre TkatchenkoProfessor of Physics, University of Luxembourg; Visiting Professor, TU BerlinVerified email at uni.lu
J. Karl Johnsonprofessor of chemcial engineering, university of pittsburghVerified email at pitt.edu
Thomas B. RauchfussUniversity of Illinois at Urbana-ChampaignVerified email at illinois.edu
Yogesh SurendranathMassachusetts Institute of TechnologyVerified email at mit.edu
Robert H. MorrisProfessor of ChemistryVerified email at chem.utoronto.ca

John A. Keith

R.K. Mellon Faculty Fellow in Energy, Associate Professor, Chemical & Petroleum Engineering, PITT

Verified email at pitt.edu - Homepage

Computational chemistry catalysis energy materials green chemical design


Title Sort by citations Sort by year Sort by title	Cited by Cited by	Year
Water oxidation on pure and doped hematite (0001) surfaces: Prediction of Co and Ni as effective dopants for electrocatalysis P Liao, JA Keith, EA Carter Journal of the American Chemical Society 134 (32), 13296-13309, 2012	484	2012
The mechanism of the Wacker reaction: a tale of two hydroxypalladations JA Keith, PM Henry Angewandte Chemie International Edition 48 (48), 9038-9049, 2009	307*	2009
Elucidation of the Selectivity of Proton-Dependent Electrocatalytic CO₂ Reduction by fac-Re(bpy)(CO)₃Cl JA Keith, KA Grice, CP Kubiak, EA Carter Journal of the American Chemical Society 135 (42), 15823-15829, 2013	265	2013
Theoretical Studies of Potential‐Dependent and Competing Mechanisms of the Electrocatalytic Oxygen Reduction Reaction on Pt (111) JA Keith, T Jacob Angewandte Chemie International Edition 49 (49), 9521-9525, 2010	237	2010
Theoretical Investigations of the Oxygen Reduction Reaction on Pt (111) JA Keith, G Jerkiewicz, T Jacob ChemPhysChem 11 (13), 2779-2794, 2010	225	2010
Theoretical elucidation of the competitive electro-oxidation mechanisms of formic acid on Pt (111) W Gao, JA Keith, J Anton, T Jacob Journal of the American Chemical Society 132 (51), 18377-18385, 2010	215	2010
Theoretical Insights into Pyridinium-Based Photoelectrocatalytic Reduction of CO₂ JA Keith, EA Carter Journal of the American Chemical Society 134 (18), 7580-7583, 2012	204	2012
Using nature’s blueprint to expand catalysis with Earth-abundant metals RM Bullock, JG Chen, L Gagliardi, PJ Chirik, OK Farha, CH Hendon, ... Science 369 (6505), eabc3183, 2020	198	2020
Combining Machine Learning and Computational Chemistry for Predictive Insights Into Chemical Systems JA Keith, V Vassilev-Galindo, B Cheng, S Chmiela, M Gastegger, ... Chemical Reviews 121 (16), 9816-9872, 2021	170	2021
Ab Initio DFT+U Analysis of Oxygen Vacancy Formation and Migration in La_1-xSr_xFeO_3-δ (x = 0, 0.25, 0.50) AM Ritzmann, AB Muñoz-García, M Pavone, JA Keith, EA Carter Chemistry of Materials 25 (15), 3011-3019, 2013	169	2013
The inner-sphere process in the enantioselective Tsuji allylation reaction with (S)-t-Bu-phosphinooxazoline ligands JA Keith, DC Behenna, JT Mohr, S Ma, SC Marinescu, J Oxgaard, ... Journal of the American Chemical Society 129 (39), 11876-11877, 2007	136	2007
Electrochemical reactivities of pyridinium in solution: consequences for CO 2 reduction mechanisms JA Keith, EA Carter Chemical Science 4 (4), 1490-1496, 2013	133	2013
The Electronic States of Rhenium Bipyridyl Electrocatalysts for CO2 Reduction as Revealed by X‐ray Absorption Spectroscopy and Computational Quantum Chemistry EE Benson, MD Sampson, KA Grice, JM Smieja, JD Froehlich, D Friebel, ... Angewandte Chemie 125 (18), 4941-4944, 2013	128	2013
Unraveling the Wacker Oxidation Mechanisms JA Keith, RJ Nielsen, J Oxgaard, WA Goddard III Journal of the American Chemical Society 129 (41), 12342-12343, 2007	127	2007
Oxygen transport in perovskite-type solid oxide fuel cell materials: insights from quantum mechanics AB Muñoz-García, AM Ritzmann, M Pavone, JA Keith, EA Carter Accounts of chemical research 47 (11), 3340-3348, 2014	112	2014
The reaction mechanism of the enantioselective Tsuji allylation: inner-sphere and outer-sphere pathways, internal rearrangements, and asymmetric C–C bond formation JA Keith, DC Behenna, N Sherden, JT Mohr, S Ma, SC Marinescu, ... Journal of the American Chemical Society 134 (46), 19050-19060, 2012	104	2012
Quantum chemical benchmarking, validation, and prediction of acidity constants for substituted pyridinium ions and pyridinyl radicals JA Keith, EA Carter Journal of chemical theory and computation 8 (9), 3187-3206, 2012	99	2012
Ab initio DFT+ U analysis of oxygen transport in LaCoO 3: the effect of Co 3+ magnetic states AM Ritzmann, M Pavone, AB Muñoz-García, JA Keith, EA Carter Journal of Materials Chemistry A 2 (21), 8060-8074, 2014	91	2014
Size-extensivity-corrected multireference configuration interaction schemes to accurately predict bond dissociation energies of oxygenated hydrocarbons VB Oyeyemi, DB Krisiloff, JA Keith, F Libisch, M Pavone, EA Carter The Journal of chemical physics 140 (4), 044317, 2014	84	2014
Reactive forcefield for simulating gold surfaces and nanoparticles JA Keith, D Fantauzzi, T Jacob, ACT van Duin Physical Review B 81 (23), 235404, 2010	83	2010

The system can't perform the operation now. Try again later.

Articles 1–20

Citations per year

Duplicate citations

Merged citations

Add co-authorsCo-authors

Follow

Cited by

Co-authors