2021

T.M. Narayanan, Y. Zhu, E. Gencer, G. McKinley and Y. Shao-Horn
Low-cost manganese dioxide semi-solid electrode for flow batteries
Joule, [DOI: 10.1016/j.joule.2021.07.010], September 2021.

X. Cai, C. Fu, H. Iriawan, F. Yang, A. Wu, L. Luo, S. Shen, G. Wei, Y. Shao-Horn and J. Zhang
Lithium-mediated electrochemical nitrogen reduction: mechanistic insights to enhance performance
iScience, [DOI: 10.1016/j.isci.2021.103105], September 2021.

T. Wang, Y. Zhang, B. Huang, B. Cai, R.R. Rao, L. Giordano, S.G. Sun and Y. Shao-Horn
Enhancing the Catalysis of Oxygen Reduction Reaction via Tuning Interfacial Hydrogen Bonds
Nature Catalysis, 4, 753-762, September 2021.

J.J. Giner-Sanz, G. Leverick, V. Pérez-Herranz and Y. Shao-Horn
Optimization of the salicylate method for ammonia quantification from nitrogen electroreduction
Journal of Electroanalytical Chemistry, 896, 115250, September 2021.

B. Huang, R.R. Rao, S. You, K. H. Myint, Y. Song, Y. Wang, W. Ding, L. Giordano, Y. Zhang, T. Wang, S. Muy, Y. Katayama, J. C. Grossman, A. P. Willard, K. Xu, Y. Jiang and Y. Shao-Horn
Cation- and pH-Dependent Hydrogen Evolution and Oxidation Reaction Kinetics
Journal of the American Chemical Society Au, [DOI: 10.1021/jacsau.1c00281], August 2021.

X. He, D. Bresser, S. Passerini, F. Baakes, U. Krewer, J. Lopez, C. Mallia, Y. Shao-Horn, I. Cekic-Laskovic, S. Wiemers-Meyer, F. Soto, V. Ponce, J. Seminario, P. Balbuena, H. Jia, W. Xu, Y. Xu, C. Wang, B. Horstmann, R. Amine, C.C. Su, J.Y. Shi, K. Amine, M. Winter, A. Latz and R. Kostecki
The passivity of lithium electrodes in liquid electrolyte for secondary batteries
Nature Review Materials, [DOI: 10.1038/s41578-021-00345-5], August 2021.

H. Iriawan, S.Z. Andersen, X. Zhang, B. M. Comer, J. Barrio, P. Chen, A.J. Medford, I.E.L. Stephens, I. Chorkendorff and Y. Shao-Horn
Methods for nitrogen activation by reduction and oxidation
Nature Reviews Methods Primers, [DOI: 10.1038/s43586-021-00053-y], August 2021.

B. Horstmann, J. Shi, R. Amine, M. Werres,X. He,H. Jia, F. Hausen, I. Cekic-Laskovic, S. Wiemers-Meyer, J. Lopez, D. Galvez-Aranda, Baakes, D. Bresser, C.-C. Su, Y. Xu, W. Xu, P. Jakes, R.-A. Eichel, E. Figgemeier, U. Krewer, J. M. Seminario, P.B. Balbuena, C. Wang, S. Passerini, Y. Shao-Horn, M. Winter, K. Amine, R. Kostecki and A. Latz
Strategies Towards Enabling Lithium Metal in Batteries: Interphases and Electrodes
Energy and Environmental Science, [DOI: 10.1039/D1EE00767J], July 2021.

X. Cai, H. Iriawan, F. Yang, L. Luo, S. Shen, Y. Shao-Horn and J. Zhang
Interaction of Ammonia with Nafion and Electrolyte in Electrocatalytic Nitrogen Reduction Study
Journal of Physical Chemistry Letters, 12, 6861-6866, July 2021.

J. Hwang, R.R. Rao, L. Giordano, K. Akkiraju, X.R. Wang, E. Crumlin and Y. Shao-Horn
Regulating oxygen activity of perovskites to promote NOx oxidation
Nature Catalysis, 4, 663-673, July 2021.

N. Minafra, J. A. Johnson and Y. Shao-Horn
Finding the right balance
Nature Energy, 6, 692-693, June  2021.

Y. Yu, Y. R. Zhang, L. Giordano, Y. G. Zhu, F. Maglia, R. Jung, F.S. Gittleson and Y. Shao-Horn
Enhanced cycling of Ni-rich positive electrodes by fluorine modification
Journal of the Electrochemical Society 168, 060538, June 2021.

S. Wang, Z. Huang, W. Shi, D. Lee, Q. Wang, W. Shang, Y. Stein, Y. Shao-Horn, T. Deng, B.L. Wardle and K. Cui
Unzipping Carbon Nanotube Bundles through NH−π Stacking for Enhanced Electrical and Thermal Transport
ACS Applied Material Interfaces, 13, 28583–28592, June 2021.

K. Gordiz, S. Muy, W. G. Zeier, Y. Shao-Horn and A. Henry
Enhancement of ion diffusion by targeted phonon excitation
Cell Reports Physical Science, 2, 100431, May 2021.

R. R. Rao, Huang, Y. Katayama, J. Hwang, T. Kawaguchi, J.R. Lunger, J. Peng, Y. Zhang, A. Morinaga, H. Zhou, H. You and Y. Shao-Horn
pH- and Cation-Dependent Water Oxidation on Rutile RuO2(110)
Journal of Physical Chemistry C, 125, 8195–8207, April 2021.

W. Xue, M. Huang, Y. Li, Y. Zhu, R. Gao, X. Xiao, W. Zhang, S. Li, G. Xu, Y. Yu, P. Li, J. Lopez, D. Yu, Y. Dong, W. Fan, Z. Shi, R. Xiong, C.-J. Sun, I. Hwang, W.-K. Lee, Y. Shao-Horn, J.A. Johnson and J. Li
Ultra-high-voltage Ni-rich layered cathodes in practical Li metal batteries enabled by a sulfonamide-based electrolyte
Nature Energy, 6, 495-505, March 2021.

Y. Yu, P. Karayaylali, D. Sokaras, L. Giordano, R. Kou, C. Sun, F. Maglia, R. Jung, F.S. Gittleson and Y. Shao-Horn
Towards controlling the reversibility of anionic redox in transition metal oxieds for high-energy Li-ion positive electrodes
Energy and Environmental Science, 14, 2322-2334, February 2021.

B. Huang, K.H. Myint, Y. Wang, Y. Zhang, R.R. Rao, J. Sun, S. Muy, Y. Katayama, J. Corchado Garcia, D. Fraggedakis, J.C. Grossman, M.Z. Bazant, K. Xu, A.P. Willard and Y. Shao-Horn
Cation-Dependent Interfacial Structures and Kinetics for Outer-Sphere Electron-Transfer Reactions
Journal of Physical Chemistry C, 125, 4397-4411, February 2021.

D. Fraggedakis, M. McEldrew, R.B. Smith, Y. Krishnan, Y. Zhang, P. Bai, W. C. Chueh, Y. Shao-Horn and M.Z. Bazant
Theory of coupled ion-electron transfere kinetics
Electrochemica Acta, 367, 137432, January 2021

S. Khan, J. Hwang, Y. Shao-Horn and K. Varanasi
Catalyst-proximal plastrons enhance activity and selectivity of carbon dioxide electroreduction
Cell Reports Physical Science, 2, 100318, January 2021.

A. I. Inozemtseva, E.Y. Kataev, A.S. Froloy, M. Amati, L. Gregoratti, K. Beranova, V. Perez Dieste, C. Escudero, A. Federov, A. V. Tarasov, D. Y. Usachov, D. Vyalikh, Y. Shao-Horn, D. M. Itkis and L. V. Yashina
On the catalytic and degradative role of oxygen-containing groups on carbon electrode in non-aqueous ORR
Carbon, 176, 632-641, January 2021.

W. Zhang, S. Feng, M. Huang, B. Qiao, K. Shigenobu, L. Giordano, J. Lopez, R. Tatara, K. Ueno, K. Dokko, M. Watanabe, Y. Shao-Horn and J.A. Johnson
Molecularly Tunable Polyanions for Single-Ion Conductors and Poly(solvate ionic liquids)
Chemistry of Materials, 33, 524-534, January 2021.

2020

S. Muy, R. Schlem, Y. Shao-Horn, and W.G Zeier
Phonon–Ion Interactions: Designing Ion Mobility Based on Lattice Dynamics
Advanced Energy Materials, 11, 2002787, December 2020.

S. Tsuji, S. Sako, K. Nitta, K. Yamamoto, Y. Shao-Horn, Y. Uchimoto and Y. Orikasa
Surface analysis of lanthanum strontium cobalt oxides under cathodic polarization at high temperature through operando total-reflection X-ray absorption and X-ray fluorescence spectroscopy
Solid State Ionics, 357, 115502, December 2020.

Y. Yu, P. Karayaylali, L. Giordano, J. Corchado-García, J. Hwang, D. Sokaras, F. Maglia, R. Jung, F. S. Gittleson, and Y. Shao-Horn
Probing Depth-Dependent Transition-Metal Redox of Lithium Nickel, Manganese, and Cobalt Oxides in Li-Ion Batteries
ACS Applied Materials and Interfaces, 31, December 2020.

E. Crabb, A. France-Lanord, G. Leverick, R. Stephens, Y. Shao-Horn, and J.C. Grossman
Importance of Equilibration Method and Sampling for Ab Initio Molecular Dynamics Simulations of Solvent–Lithium-Salt Systems in Lithium-Oxygen Batteries
Journal of Chemical Theory and Computation, 16, 7255-7266, November 2020.

T. Khudiyev, J. T. Lee, J. R. Cox, E. Argentieri, G. Loke, R. Yuan, G. H. Noel, R. Tatara, Y. Yu, F. Logan, J. Joannopoulos, Y. Shao-Horn, and Y. Fink
100 m Long Thermally Drawn Supercapacitor Fibers with Applications to 3D Printing and Textiles
Advanced Materials, 32, 2004971, November 2020.

J. J. Giner Sanz, G. Leverick, V. Perez-Herranz, and Y. Shao-Horn
Salicylate Method for Ammonia Quantification in Nitrogen Electroreduction Experiments: The Correction of Iron III Interference
Journal of the Electrochemical Society, 167, 134519, October 2020.

S. Yuan, Li, J. Peng, Y. M. Questell-Santiago, K. Akkiraju, L. Giordano, D.J. Zheng, S. Bagi, Y. Roman-Leshkov, and Y. Shao-Horn
Conversion of Methane in Liquid Fuels – Bridging Thermal Catalysis with Electrocatalysis
Advanced Energy Materials, 10, 2002154, September 2020.

T.-H. Shen, L. Spillane, J. Vavra, T. H. M. Pham, Y. Shao-Horn, and V. Tileli
Oxygen Evolution Reaction in Ba5Sr0.5Co0.8Fe0.2O3-δ Aided by Intrinsic Co/Fe Spinel-Like Surface
Journal of the American Chemical Society, 142, 15876-15833, August 2020.

R. R. Rao, M. Tulodziecki, B. Han, M. Risch, A. Abakumov, Y. Yu, P. Karayayalali, M. Gauthier, M. Escudero-Escribano, Y. Orikasa, and Y. Shao-Horn
Reactivity with Water and Bulk Ruthenium Redox of Lithium Ruthenate in Basic Solutions
Advanced Functional Materials, 31, 2002249 , July 2020.

B. Qiao., S. Mohapatra, J. Lopez, G.M. Leverick, R. Tatara, Y. Shibuya, Y. Jiang, A. France-Lanord, J.C. Grossman, R. Gomez-Bombarelli, J.A. Johnson, and Y. Shao-Horn
Quantitative Mapping of Molecular Substituents to Macroscopic Properties Enables Predictive Design of Oligoethylene Glycol-Based Lithium Electrolytes
ACS Central Science, 6, 1115-1128, June 2020.

Y. Zhu, T.N. Narayanan, M. Tulodziecki, H. Sanchez-Casalongue, Q. Horn, L. Meda, Y. Yu, T. Regier, G.H. McKinley, and Y. Shao-Horn
High-energy and high-power Zn-Ni flow batteries with semi-solid electrodes
Sustainable Energy and Fuels, 4, 4076-4085, June 2020.

N. Charles, Y. Yu, L. Giordano, R. Jung, F. Maglia, and Y. Shao-Horn
Towards Establishing Electronic and Phononic Signatures of Reversible Lattice Oxygen Oxidation in Lithium Transition Metal Oxides for Li-Ion Batteries
Chemistry of Materials, 32, 5502-5514, May 2020.

D. Fraggedakis, T. Gao, T. Zhou, Y. Zhang, Y. Han, R.M. Stephens, Y. Shao-Horn, and M.Z. Bazant
A scaling law to determine phase morphologies during ion intercalation
Energy and Environmental Sciences, 13, 2142-2152, May 2020.

T. Kawaguchi, R.R. Rao, J.R. Lunger, Y. Liu, D. Walko, E.A. Karapetrova, V. Komanicky, Y. Shao-Horn, and H. You
Stern layers on RuO2 (100) and (110) in electrolyte: Surface X-ray scattering studies
Journal of Electroanalytical Chemistry, 875, 114228, May 2020.

R. R. Rao, J. Kolb, L. Giordano, A. F. Pederson, Y. Katayama, J. Hwang, A. Mehta, H. You, J.R. Lunger, H. Zhou, N.B. Halck, T. Vegge, I. Chorkendorff, I.E.L. Stephens, and Y. Shao-Horn
Operando Identification of Site-Dependent Water Oxidation Activity on Ruthenium Dioxide Single-Crystal Surfaces
Nature Catalysis, 3, 516-525, May 2020.

Y. Wang, T. Xie, A. France-Lanord, A. Berkley, J.A. Johnson, Y. Shao-Horn, and J.C. Grossman
Towards Designing Highly Conductive Polymer Electrolyte by Machine Learning Assisted Coarse-Grained Molecular Dynamics
Chemistry of Materials, 32, 4144-4151, April 2020.

S. Han, C. Cai, Y. Zhu, Q. Sun, Y. Zhu, H. Li, H. Wang, Y. Shao-Horn, A.X. Sun and M. Gu
Interrogation of the Reaction Mechanism in a Na-O2 Battery Using In-Situ Transmission Electron Microscopy
ACS Nano, 14, 3669-3677, March 2020.

G. Leverick, R. Tatara, S. Feng, E. Crabb, A. France-Lanord, M. Tulodziecki, J. Lopez, R.M. Stephens, J.C. Grossman and Y. Shao-Horn
Solvent- and Anion-Dependent Li+–O2 Coupling Strength and Implications on the Thermodynamics and Kinetics of Li–O2 Batteries
Journal of Physical Chemistry C, 124, 4953-4967, March 2020.

D. Göhl, A. Garg, P. Paciok,  K. J. J. Mayrhofer , M. Heggen, Y. Shao-Horn, R. E. Dunin-Borkowski4, Y. Román-Leshkov , M. Ledendecker
Engineering stable electrocatalysts by synergistic stabilization between carbide cores and Pt shells
Nature Materials, 19, 287-291, March 2020.

N. Gallagher, H. Z. Ye, J. Lopez, Y. Zhu, T. Van Voorhis, Y. Shao-Horn, J. A. Johnson
An N-Heterocyclic Carbene Derived Distonic Radical Cation
Angewandte Chemie (International ed. in English), 59, 3952-3955, March 2020.

P. Karayaylali, Y. Zhang, L. Giordano, Y. Katayama, R. Tatara, Y. Yu, F. Maglia, R. Jung and Y. Shao-Horn
The Role of Diphenyl Carbonate Additive on the Interfacial Reactivity of Positive Electrodes in Li-ion Batteries
Journal of the Electrochemical Society, 167, 040522, March 2020.

C. Li, Y., Y. Yu, C. Wang, Y. Zhang, S. Zheng, J.F. Li, F. Maglia, R. Jung, Z.Q. Tian and Y. Shao-Horn
Surface Changes of LiNixMnyCo1-x-yO2 in Li-Ion Batteries Using In Situ Surface-Enhance Raman Spectroscopy
Journal of Physical Chemistry C, 124, 4024-4031, February 2020.

D. Kuznetsov, J. Peng, L. Giordano, Y. Román-Leshkov and Y. Shao-Horn
Bismuth Substituted Strontium Cobalt Perovskites for Catalyzing Oxygen Evolution
Journal of Physical Chemistry C, 124, 6652-6570, February 2020.

R. Schlem, S. Muy, N. Prinz, A. Banik, Y. Shao-Horn, M. Zobel and W.G. Zeier
Mechanochemical Synthesis: A Tool to Tune Cation Site Disorder and Ionic Transport Properties of Li3MCl6 (M = Y, ER) Superionic Conductors
Advanced Energy Materials, 1903719, February 2020.

A. France-Lanord, Y. Wang, T. Xie, J.A. Johnson, Y. Shao-Horn and J.C. Grossman
The effect of chemical variations in the structure of poly(ethylene oxide)-based polymers on lithium transport in concentrated electrolytes
Chemistry of Materials 2019, 32, 121-126, February 2020.

W. Xue, Z. Shi, M. Huang, S. Feng, C. Wang, F. Wang, J. Lopez, B. Qiao, G. Xu, W. Zhang, Y. Dong, R. Gao, Y. Shao-Horn, J.A. Johnson and J. Li
FSI-inspired solvent and “full fluorosulfonyl” electrolyte for 4V-class lithium-metal batteries
Energy and Environmental Science, 13, 212-220, January 2020.

Y. Zhang, Y. Katayama, R. Tatara, L. Giordano, Y. Yu, D. Fraggedakis, J. Sun, F. Maglia, R. Jung, M. Z. Bazant and Y. Shao-Horn
Revealing Electrolyte Oxidation via Carbonate Dehydrogenation on Ni-based Oxides in Li-ion Batteries by in situ Fourier Transform Infrared Spectroscopy
Energy and Environmental Science, 13, 183-199, January 2020.

2019

M. Aykol, J.S. Hummelshøj, A. Anapolsky, K. Aoyagi, M.Z. Bazant, T. Bligaard, R.D. Braatz, S. Broderick, D. Cogswell, J. Dagdelen, W. Drisdell, E. Garcia, K. Garikipati, V. Gavini, W. E. Gent, L. Giordano, C. P. Gomes, R. Gomez-Bombarelli, C.B. Gopal, J. M. Gregoire, J. C. Grossman, P. Herring, L. Hung, T.F. Jaramillo, L. King, H. Kwon, R. Maekawa, A. M. Minor, J. H. Montoya, T.Mueller, C. Ophus, K. Rajan, R.Ramprasad, Brian Rohr, D. Schweigert, Y. Shao-Horn, Y. Suga, S. K. Suram, V. Viswanathan, J.F. Whitacre, A. P. Willard, O. Wodo, C. Wolverton and B. D. Storey
The Materials Research Platform: Defining the Requirements from User Stories
Matter, 1, 1433-1438, December 2019.

W.P. Mounfield, B. Huang, B. Cai, Y. Shao-Horn and Y. Román-Leshkov
Synthesis of unsupported two-dimensional molybdenum carbide nanosheets for hydrogen evolution
Materials Letters, 261, 126987, November 2019.

S. Yuan; J. Peng, Y. Zhang and Y. Shao-Horn
Stability Trend of Metal–Organic Frameworks with Heterometal-Modified Hexanuclear Zr Building Units
The Journal of Physical Chemistry C, 123, 28266-28274, October 2019.

B. Cai, K. Akkiraju, W. Mounfield, X. Li, Z. Wang, B. Huang, S. Yuan, D. Su, Y. Román-Leshkov and Y. Shao-Horn
Solid-state gelation for nanostructured perovskite oxide aerogels
Chemistry of Materials, 31, 9422-9429, October 2019.

Y. Yang, P. Karayaylali, S. Nowak, L. Giordano, M. Gauthier, W. Hong, R. Kou, Q. Li, J. Vinson, T. Kroll, D. Sokaras, C.J. Sun, N. Charles, F. Maglia, R. Jung and Y. Shao-Horn
Revealing Electronic Signatures of Lattice Oxygen Redox in Lithium Ruthenates and Implications for High-Energy Li-ion Battery Material Designs
Chemistry of Materials, 31, 7865-7879, October 2019.

S. Feng, M. Huang, J. R. Lamb, W. Zhang, R. Tatara, Y. Zhang, Y.-G. Zhu, C. F. Perkinson, J. A. Johnson, and Y. Shao-Horn
Molecular Design of Stable Sulfamide- and Sulfonamide-Based Electrolytes for Aprotic Li-O2 Batteries
Chem 2019 5, 2630-2641, October 2019.

J. Hwang, K. Akkiraju, J. Corchado-García, and Y. Shao-Horn
A Perovskite Electronic Structure Descriptor for Electrochemical CO2 Reduction and the Competing H2 Evolution Reaction
Journal of Physical Chemistry C, 123, 24469-24476, September 2019.

R. Tatara, Y. Yu, P. Karayaylali, A. K. Chan, Y. Zhang, R. Jung, F. Maglia, L. Giordano, and Y. Shao-Horn
Enhanced Cycling Performance of Ni-rich Positive Electrodes (NMC) in Li-ion Batteries by Reducing Electrolyte Free-solvent Activity
ACS Applied Materials and Interfaces, 11, 34973-34988, August 2019.

M. Huang, S. Feng, W. Zhang, J. Lopez, B. Qiao, R. Tatara, L. Giordano, Y. Shao-Horn, and J. A. Johnson
Design of S-Substituted Fluorinated Aryl Sulfonamide-Tagged (S-FAST) Anions To Enable New Solvate Ionic Liquids for Battery Applications
Chemistry of Materials, 31, 7558-7564, August 2019.

L. Giordano, T. M. Østergaard, S. Muy, Y. Yu, N. Charles, S. Kim, Y. Zhang, F. Maglia, R. Jung, I. Lund, J. Rossmeisl, and Y. Shao-Horn
Ligand-Dependent Energetics for Dehydrogenation: Implications in Li-Ion Battery Electrolyte Stability and Selective Oxidation Catalysis of Hydrogen-Containing Molecules
Chemistry of Materials, 31, 5464-5474, July 2019.

S. Muy, J. Voss, R. Schlem, R. Koerver, S. J. Sedlmaier, F. Maglia, P. Lamp, W.G. Zeier, and Y. Shao-Horn
High-Throughput Screening of Solid-State Li-Ion Conductors Using Lattice-Dynamics Descriptors
iScience, 270-282, June 2019.

T. Xie, A. France-Lanord, Y. Wang, Y. Shao-Horn, and J. C. Grossman
Graph dynamical networks for unsupervised learning of atomic scale dynamics in materials
Nature Communications 10, 2667, June 2019.

T. P. Batcho, G. Leverick, Y. Shao-Horn, and C. V. Thompson
Modeling the Effect of Lithium Superoxide Solvation and Surface Reduction Kinetics on Discharge Capacity in Lithium–Oxygen Batteries
Journal of Physical Chemistry C, 123, 14272-14282, June 2019.

S. Mezzavilla, Y. Katayama, R. R. Rao, J. Hwang, A. Regoutz, Y. Shao-Horn, I. Chorkendorff, and I. E. L. Stephens
Activity–or Lack Thereof–of RuO2-Based Electrodes in the Electrocatalytic Reduction of CO2
Journal of Physical Chemistry C, 123, 17765-17773, June 2019.

A. K. Chan, R. Tatara, S. Feng, P. Karayaylali, J. Lopez, I. E. L. Stephens, and Y. Shao-Horn
Concentrated Electrolytes for Enhanced Stability of Al-Alloy Negative Electrodes in Li-Ion Batteries
Journal of Electrochemical Society, 166, A1867-A1874, June 2019.

R. Ignatans, G. Mallia, E. A. Ahmad, L. Spillane, K. A. Stoerzinger, Y. Shao-Horn, N. M. Harrison, and V. Tileli
The Effect of Surface Reconstruction on the Oxygen Reduction Reaction Properties of LaMnO3
Journal of Physical Chemistry C, 123, 116271-11627, May 2019.

J. Hwang, Z. Feng, N. Charles, X. R. Wang, D. Lee, K. A. Stoerzinger, S. Muy, R. R. Rao, D. Lee, R. Jacobs, D. Morgan, and Y. Shao-Horn
Tuning perovskite oxides by strain: electronic structure, properties, and unctions in (electro)catalysis and ferroelectricity
Materials Today,  31, 100-118, April 2019.

T. Zakharchenko, M. Avdeev, A. V. Sergeev, A. V. Chertovich, O. I. Ivankov, V. I. Petrenko, Y. Shao-Horn, L. V. Yashina, and D. M. Itkis
Small-angle Neutron Scattering Studies of Pore Filling in Carbon Electrodes: Mechanisms Limiting Lithium-Air Battery Capacity
Nanoscale, 11, 6838-6845, April 2019.

A. Aspuru-Guzik, M-H. Baik, S. Balasubramanian, R. Banerjee, S. Bart, N. Borduas-Dedekind, S. Chang, P. Chen, C. Corminboeuf, F.-X. Coudert, L. Cronin, C. Crudden, T. Cuk, A. G. Doyle, C. Fan, X. Feng, D. Freedman, S. Furukawa, S. Ghosh, F. Glorius, M. Jeffries-EL, N. Katsonis, A. Li, S. S. Linse, S. Marchesan, N. Maulide, A. Milo, A. R. H. Narayan, P. Naumov, C. Nevado, T. Nyokong, R. Palacin, M. Reid, C. Robinson, G. Robinson, R. Sarpong, C. Schindler, G. S. Schlau-Cohen, T. W. Schmidt, R. Sessoli, Y. Shao-Horn, H. Sleiman, J. Sutherland, A. Taylor, A. Tezcan, M. Tortosa, A. Walsh, A. J. B. Watson, B. M. Weckhuysen, E. Weiss, D. Wilson, V. W.-W. Yam, X. Yang, J. Y. Ying, T. Yoon, S.-L. You, A. J. G. Zarbin, and H. Zhang
Charting a course for chemistry
Nature Chemistry, 11, 286-294 April 2019.

G. Leverick, M. Tulodziecki, R. Tatara, F. Barde, and Y. Shao-Horn
Solvent-Dependent Oxidizing Power of LiI Redox Couples for Li-O2 Batteries
Joule, 3, 1106-1126, April 2019.

T. Qiu, Z. Liang, W. Guo, S. Gao, C. Qu, H. Tabassum, H. Zhang, B. Zhu, R. Zou, and Y. Shao-Horn
Highly Exposed Ruthenium-based Electrocatalysts from Bimetallic Metal-organic Frameworks for Overall Water Splitting
Nano Energy, 58, 1-10, April 2019.

Y. Katayama, F. Nattino, L. Giordano, J. Hwang, R. R. Rao, O. Andreussi, N. Marzari, and Y. Shao-Horn
An In Situ Surface-Enhanced Infrared Absorption Spectroscopy Study of Electrochemical CO2 Reduction: Selectivity Dependence on Surface C-Bound and O-Bound Reaction Intermediates
Journal of Physical Chemistry C, 123, 5951-5963 March 2019.

P. Karayaylali, R. Tatara, Y. Zhang, K-L. Chan, Y. Yu, L. Giordano, F. Maglia, R. Jung, I. Lund, and Y. Shao-Horn
Coating-Dependent Electrode-Electrolyte Interface for Ni-Rich Positive Electrodes in Li-Ion Batteries
Journal of the Electrochemical Society, 166, A1022-A1030, March 2019.

EC. Wei, R. R. Rao, J .Peng, B. Huang, I. E. Stephens, M. Risch, Z. J. Xu, and Y. Shao-Horn
Recommended Practices and Benchmark Activity for Hydrogen and Oxygen Electrocatalysis in Water Splitting and Fuel Cells
Advanced Materials 2019, 31, 180296, January 2019.

R. Jacobs, J. Hwang, Y. Shao-Horn, and D. Morgan
Assessing correlations of perovskite catalytic performance with electronic structure descriptorsChemistry of Materials, 31, 785-797, January 2019.

Z.H. Zhu, J. Strempfer, R.R. Rao, C.A. Occhialini, J. Pelliciari, Y. Choi, T. Kawaguchi, H. You, J.F. Mitchell, Y. Shao-Horn, and R. Comin
Anomalous Antiferromagnetism in Metallic RuO2 Determined by Resonant X-ray Scattering
Physical Review Letters, 122, 017202, January 2019.

R. Tatara, P. Karayaylali, Y. Yu, Y. Zhang, L. Giordano, F. Maglia, R. Jung, J. P. Schmidt, I. Lund, and Y. Shao-Horn
The Effect of Electrode-Electrolyte Interface on the Electrochemical Impedance Spectra for Positive Electrode in Li-Ion Battery
Journal of the Electrochemical Society, 166, A5090-A5098, January 2019.

2018

K. A. Stoerzinger, X. R. Wang, J. Hwang, R. R. Rao, W. T. Hong, C. M. Rouleau, D. Lee, Y. Yu, E. J. Crumlin, Y. Shao-Horn
Speciation and Electronic Structure of La1−xSrxCoO3−δ During Oxygen Electrolysis
Topics in Catalysis, 61, 2161-2174, December 2018.

B. J. Hopkins, Y. Shao-Horn, and D. P. Hart
Suppressing corrosion in primary aluminum–air batteries via oil displacement
Science, 362, 658-661, November 2018.

D. Lee, J. Zhou, G. Chen, and Y. Shao-Horn
Enhanced Thermoelectric Properties for PEDOT:PSS/Undoped Ge Thin‐Film Bilayered Heterostructures Advanced Electronic Materials, 5, 1800624, November 2018.

Y. Yu, P. Karayaylali, Y. Katayama, L. Giordano, M. Gauthier, F. Maglia, R. Jung, I. Lund, and Y. Shao-Horn
Coupled LiPF6 Decomposition and Carbonate Dehydrogenation Enhanced by Highly Covalent Metal Oxides in High-Energy Li-Ion Batteries
J. Phys. Chem. C 2018, 122, 48, 27368-27382

Y. Shibuya, R. Tatara, Y. Jiang, Y. Shao-Horn, and J. A. Johnson
Brush-First ROMP of poly(ethylene oxide) macromonomers of varied length: impact of polymer architecture on thermal behavior and li+ conductivity
Journal of Polymer Science, Part A, 57, 448-455, October 2018.

W. Kong, H. Li, K. Qiao, Y. Kim, K. Lee, Y. Nie, D. Lee, T. Osadchy, R. J. Molnar, D. K. Gaskill, R. L. Myers-Ward, K. M. Daniels, Y. Zhang, S. Sundram, Y. Yu, S. Bae, S. Rajan, Y. Shao-Horn, K. Cho, A. Ougazzaden, J. C. Grossman, and J. Kim
Polarity governs atomic interaction through two-dimensional materials
Nature Materials 17, 999–1004 (2018)

T. Krauskopf, S. Muy, S. P. Culver, S. Ohno, O. Delaire, Y. Shao-Horn, and W. G. Zeier
Comparing the descriptors for investigating the influence of lattice dynamics on ionic transport using the superionic conductor Na3PS4-xSex
J. Am. Chem. Soc. 2018, 140, 43, 14464-14473

X. Wang, X. Zhang, L. Sun, D. Lee, S. Lee, M. Wang, J. Zhao, Y. Shao-Horn, M. Dinca, T. Palacios, and K. K. Gleason
High electrical conductivity and carrier mobility in oCVD PEDOT thin films by engineered crystallization and acid treatment
Science Advances 14 Sep 2018, Vol. 4, no. 9, eaat5780

R. R. Rao, M. J. Kolb, J. Hwang, A. F. Pedersen, A. Mehta, H. You, K. A. Stoerzinger, Z. Feng, H. Zhou, H. Bluhm, L. Giordano, I. E. L. Stephens, and Y. Shao-Horn
Surface Orientation Dependent Water Dissociation on Rutile Ruthenium Dioxide
J. Phys. Chem. C, 2018, 122 (31), pp 17802–17811

J. Hwang, R. R. Rao, Y. Katayama, D. Lee, X. R. Wang, E. Crumlin, T. Venkatesan, H. N. Lee, and Y. Shao-Horn
CO2 Reactivity on Cobalt-Based Perovskites
J. Phys. Chem. C, 2018, 122 (35), pp 20391–20401

P. Sebastian, M. Tulodziecki, M. del Pilar Bernicola, V. Climent, E. Gomez, Y. Shao-Horn, and J. M. Feliu
The Use of CO as Cleaning Tool of Highly Active Surfaces in Contact with Ionic Liquids. Ni Deposition on Pt(111) Surfaces in IL
ACS Appl. Energy Mater. 2018, 1 (9), pp 4617–4625

W. Zhang, M. Huang, S. al Abdullatif, M. Chen, Y. Shao-Horn, and J. A. Johnson
Reduction of (Meth)acrylate-Based Block Copolymers Provides Access to Self-Assembled Materials with Ultrasmall Domains
Macromolecules 2018, 51 (17), pp 6757–6763

S. Muy, J.C. Bachman, H.-H. Chang, L. Giordano, F. Maglia, S. Lupart, P. Lamp, W.G. Zeier, and Y. Shao-Horn
Lithium Conductivity and Meyer-Neldel Rule in Li3PO4–Li3VO4–Li4GeO4 Lithium Superionic Conductors
Chemistry of Materials 2018, 30 (16), pp 5573–5582

S. Feng, J. R. Lunger, J. A. Johnson, and Y. Shao-Horn
Hot lithium-oxygen batteries charge ahead
Science, 2018 Vol. 361, Issue 6404, pp. 758

P. A. Linford, L. Xu, B. Huang, Y. Shao-Horn and C. V. Thompson
Multi-cell thermogalvanic systems for harvesting energy from cyclic temperature changes
J Power Sources, 2018, 399 pp 429-435

C. Roy, R. R. Rao, K. A. Stoerzinger, J. Hwang, J. Rossmeisl, I. Chorkendorff, Y. Shao-Horn and I. E. L. Stephens
Trends in Activity and Dissolution on RuO2 under Oxygen Evolution Conditions: Particles versus Well-Defined Extended Surfaces
ACS Energy Lett., 2018, 3, pp 2045–2051

D. Perego, J. S. T. Henga, X. Wang, Y. Shao-Horn and C. V.Thompson
High-performance polycrystalline RuOx cathodes for thin film Li-ion batteries
Electrochimica Acta 2018, 283, pp 228-233 DOI: 10.1016/j.electacta.2018.06.172

B. Han, M. Risch, S. Belden, S. Lee, D. Bayer, E. Mutoro and Y. Shao-Horn
Screening Oxide Support Materials for OER Catalysts in Acid
JECS 2018, 165 (10), F813-F820 DOI: 10.1149/2.0921810jes

Y. Katayama, L. Giordano, R. R. Rao, J. Hwang, H. Muroyama, T. Matsui, K. Eguchi, and Y. Shao-Horn
Surface (Electro)chemistry of CO2 on Pt Surface: An in Situ Surface-Enhanced Infrared Absorption Spectroscopy Study
JPCC 2018, 122 (23), pp 12341–12349

R. Tatara, G. M. Leverick, S. Feng, S. Wan, S. Terada, K. Dokko, M. Watanabe, and Y. Shao-Horn
Tuning NaO2 Cube Sizes by Controlling Na+ and Solvent Activity in Na-O2 Batteries
JPCC 2018, 122 (32), pp 18316–18328

K. R. Phillips, Y. Katayama, J. Hwang, and Y. Shao-Horn
Sulfide-Derived Copper for Electrochemical Conversion of CO2 to Formic Acid
JPCL 2018, 9 (15), pp 4407–4412

B. Qiao, G. M. Leverick, W. Zhao, A. H. Flood, J. A. Johnson, and Y. Shao-Horn
Supramolecular Regulation of Anions Enhances Conductivity and Transference Number of Lithium in Liquid Electrolytes
JACS 2018, 140 (35), pp 10932–10936

M. Gauthier, P. Karayaylali, L. Giordano, S. Feng, S. F. Lux, F. Maglia, P. Lamp, and Y. Shao-Horn
Probing Surface Chemistry Changes Using LiCoO2-only Electrodes in Li-Ion Batteries
JECS 2018, 165 (7), A1377-A1387

B. Huang, S. Muy, S. Feng, Y. Katayama, Y.-C. Lu, G. Chen, and Y. Shao-Horn
Non-covalent interactions in electrochemical reactions and implications for clean energy applications
Physical Chemistry Chemical Physics 2018, 20, 15680

T. M. Østergaard, L. Giordano, I. E. Castelli, F. Maglia, B. K. Antonopoulos, Y. Shao-Horn, and J. Rossmeisl
Oxidation of Ethylene Carbonate on Li Metal Oxide Surfaces
Journal of Physical Chemistry C 2018, 122 (19), pp 10442–10449

A. Chaudhuri, L. Mandal, X. Chi, M. Yang, M. C. Scott, M. Motapothula, X. J. Yu, P. Yang, Y. Shao-Horn, T. Venkatesan, A. T. S. Wee, and A. Rusydi
Direct observation of anisotropic small-hole polarons in an orthorhombic structure of BiVO4 films
Physical Review B 2018, 97, 195150

M. O. Bamgbopa, Y. Shao-Horn, R. Hashaikeh, and S. Almheiri
Cyclable membraneless redox flow batteries based on immiscible liquid electrolytes: Demonstration with all-iron redox chemistry
Electrochimimca Acta 2018, 267, 41-50

B. Han, A. Grimaud, L. Giordano, W. T. Hong, O. Diaz-Morales, L. Yueh-Lin, J. Hwang, N. Charles, K. A. Stoerzinger, W. Yang, M. T. M. Koper, and Y. Shao-Horn
Iron-Based Perovskites for Catalyzing Oxygen Evolution Reaction
Journal of Physical Chemistry C 2018, 122 (15), pp 8445–8454

W. P. Mounfield III, A. Garg, Y. Shao-Horn, and Y. Román-Leshkov
Electrochemical Oxygen Reduction for the Production of Hydrogen Peroxide
Chem 2018, 4 (1), 18-19

M. Huang, S. Feng, W. Zhang, L. Giordano, M. Chen, C. V. Amanchukwu, R. Anandakathir, Y. Shao-Horn, and J. A. Johnson
Fluorinated Aryl Sulfonimide Tagged (FAST) salts: modular synthesis and structure–property relationships for battery applications
Energy Environ. Sci. 2018, 11, 1326-1334

S. Muy, J. C. Bachman, L. Giordano, H.-H. Chang, D. L. Abernathy, D. Bansal, O. Delaire, S. Hori, R. Kanno, F. Maglia, S. Lupart, P. Lamp, and Y. Shao-Horn
Tuning mobility and stability of lithium ion conductors based on lattice dynamics
Energy Environ. Sci. 2018, 11, 850-859

D. A. Kuznetsov, B. Han, Y. Yu, R. R. Rao, J. Hwang, Y. Román-Leshkov, and Y. Shao-Horn
Tuning Redox Transitions via Inductive Effect in Metal Oxides and Complexes, and Implications in Oxygen Electrocatalysis
Joule, 2, 1–20, February 21, 2018

 

2017

I. Mustafa, M. O. Bamgbopa, E. Alraeesi, Y. Shao-Horn, H. Sun, and S. Almheiri
Insights on the Electrochemical Activity of Porous Carbonaceous Electrodes in Non-Aqueous Vanadium Redox Flow Batteries
Journal of The Electrochemical Society,164(14) A3673-A3683 (2017) Dec 2017

R. R. Rao, M. J. Kolb, N. B. Halck, A. F. Pedersen, A. Mehta, H. You, K. A. Stoerzinger, Z. Feng, H. A. Hansen, H. Zhou, L. Giordano, J. Rosmeisl, T. Vegge, I. Chorkendorff, I. Stephens, and Y. Shao-Horn
Towards identifying the active sites on RuO2 (110) in catalyzing oxygen evolution
EES DOI: 10.1039/C7EE02307C Nov 2017

K. A. Stoerzinger, W. T. Hong, X. R. Wang, R. R. Rao, S. B. Subramanyam, C. Li, * Ariando, T. Venkatesan, Q. Liu, E. J. Crumlin, K. K, Varanasi, and Y. Shao-Horn
Decreasing Hydroxylation Affinity of La(1-x)SrxMnO3 Perovskites to Promote Oxygen Reduction Electrocatalysis
Chem. Mater. DOI: 10.1021/acs.chemmater.7b03399 Nov 2017

J. Hwang, R. R. Rao, L. Giordano, Y. Katayama, Y. Yu, and Y. Shao-Horn
Perovskites in catalysis and electrocatalysis
Science 10 Nov 2017: Vol. 358, Issue 6364, pp. 751-756 Nov 2017

S. Feng, M. Chen, L. Giordano, M. Huang, W. Zhang, C. V. Amanchukwu, R. Anandakathir, Y. Shao-Horn, and J. A. Johnson
Mapping a stable solvent structure landscape for aprotic Li–air battery organic electrolytes
J. Mater. Chem. A DOI: 10.1039/C7TA08321A Nov 2017W. T. Hong, K. A. Stoerzinger, Y-L. Lee, L. Giordano, A. Grimaud, A. M. Johnson, J. Hwang, E. J. Crumlin, W. Yang, and Y. Shao-Horn,
Charge-transfer-energy-dependent oxygen evolution reaction mechanisms for perovskite oxides
EES 2017, 10, 2190-2200 Oct 2017

J. S. Elias, K. A. Stoerzinger, W. T. Hong, M. Risch, L. Giordano, A. N. Mansour, and Y. Shao-Horn,
In Situ Spectroscopy and Mechanistic Insights into CO Oxidation on Transition-Metal-Substituted Ceria Nanoparticles
ACS Catal., 2017, 7 (10), pp 6843–6857 August 2017

L. Giordano, P. Karayaylali, Y. Yu, Y. Katayama, F. Maglia, S. Lux, and Y. Shao-Horn,
Chemical Reactivity Descriptor for the Oxide-Electrolyte Interface in Li-Ion Batteries
Journal of Physical Chemistry Letters DOI: 10.1021/acs.jpclett.7b01655 July 2017

M. Risch, K. A. Stoerzinger, B. Han, T.Z. Regier, D. Peak, S. Y. Sayed, C. Wei, Z. Xu, and Y. Shao-Horn,
Redox Processes of Manganese Oxide in Catalyzing Oxygen Evolution and Reduction: An in Situ Soft X-ray Absorption Spectroscopy Study
Journal of Physical Chemistry C DOI: 10.1021/acs.jpcc.7b05592 August 2017

Tulodziecki M., G.M. Leverick, C.V. Amanchukwu, Y. Katayama, D.G. Kwabi, F. Bardé, P.T. Hammond and Y. Shao-Horn,
The role of iodide in the formation of lithium hydroxide in lithium–oxygen batteries
Energy Environmental Science DOI: 10.1039/C7EE00954B July 2017

M.O. Bamgbopa, Y. Shao-Horn and S. Almheiri ,
The Potential of Non-Aqueous Redox Flow Batteries as Fast-Charging Capable Energy Storage Solutions: Demonstration with an Iron–Chromium Acetylacetonate Chemistry
Journal of Materials Chemistry A DOI:10.1039/C7TA02022H June 2017

K.A. Stoerzinger, R.R. Rao, X.R. Wang, W.T. Hong, C.M. Rouleau, and Y. Shao-Horn,
The Role of Ru Redox in pH-Dependent Oxygen Evolution on Rutile Ruthenium Dioxide Surfaces
Chem, 2, 668-675 May 2017

N.S. Rajput, Y. Shao-Horn, X.-H. Li, G.-G. Kim, and M. Jouiad,
Investigation of Plasmonic Resonance in Metal/Dielectric Nanocavities for high-efficiency photocatalytic device
Physical Chemistry Chemical Physics DOI: 10.1039/C7CP03212A May 2017

R. Tatara, D.G. Kwabi, T.P. Batcho, M. Tulodziecki, K. Watanabe, H.-M. Kwon, M.L. Thomas, K. Ueno, C.V. Thompson, K. Dokko , Y. Shao-Horn, and M. Watanabe,
Oxygen Reduction Reaction in Highly Concentrated Electrolyte Solutions of Lithium Bis(trifluoromethanesulfonyl)amide/Dimethyl Sulfoxide
The Journal of Physical Chemistry 121, 9162–9172 May 2017

A. Grimaud, O. Diaz-Morales, B. Han, W. T. Hong, Y.-L. Lee, L. Giordano, K. A. Stoerzinger, M. T. M. Koper, and Y. Shao-Horn,
Activating lattice oxygen redox reactions in metal oxides to catalyse oxygen evolution
Nature Chemistry, 9, 457-465 May 2017

C. Wei, Z. Feng, G.G. Scherer, J. Barber, Y. Shao-Horn, and Z.J. Xu,
Cations in Octahedral Sites: A Descriptor for Oxygen Electrocatalysis on Transition-Metal Spinels
Advanced Materials DOI: 10.1002/adma.201606800 April 2017

L. Kornblum, D. P. Fenning, J. Faucher, J. Hwang, A. Boni, M. G. Han, M. D. Morales-Acosta, Y. Zhu, E. I. Altman, M. L. Lee, C. H. Ahn, F. J. Walker and Y. Shao-Horn,
Solar hydrogen production using epitaxial SrTiO3 on a GaAs photovoltaic
Energy Environmental Science, 10, 377-382 April 2017

K.A. Stoerzinger, O. Diaz-Morales, M. Kolb, R.R. Rao, R. Frydendal, L. Qiao, X.R. Wang, N.B. Halck, J. Rossmeisl, H.A. Hansen, T. Vegge, I.E.L. Stephens, M.T.M. Koper, and Y. Shao-Horn,
Orientation-Dependent Oxygen Evolution on RuO2 without Lattice Exchange
ACS Energy Letters, 2, 876-881 March 2017

R. Morasch, D.G. Kwabi, M. Tulodziecki, M. Risch, S. Zhang, and Y. Shao-Horn,
Insights into Electrochemical Oxidation of NaO2 in Na–O2 Batteries via Rotating Ring Disk and Spectroscopic Measurements
ACS Applied Materials and Interfaces 9, 4374–4381 February 2017

D. Sheberla, J. C. Bachman, J. S. Elias, C-J. Sun, Y. Shao-Horn, and M. Dinca,
Conductive MOF Electrodes for Stable Supercapacitors with High Areal Capacitance
Nature Materials 16 (2) 220-224 February 2017

B. Han, K. A. Stoerzinger, V. Tileli, A. D. Gamalski, E. A. Stach, and Y. Shao-Horn,
Nanoscale Structural Oscillations in Perovskite Oxides Induced by Oxygen Evolution
Nature Materials 16 (1) 121-126 January 2017

A.I. Belova, D.G. Kwabi, L.V. Yashina, Y. Shao-Horn, and D.M. Itkis
On the Mechanism of Oxygen Reduction in Aprotic Li-Air Batteries: The Role of Carbon Electrode Surface Structure
The Journal of Physical Chemistry C 121 (3) 1569–1577 January 2017

J. Park, M. Risch, G. Nam, M. Park, T. J. Shin, S. Park, M. G. Kim, Y. Shao-Horn, and J. Cho,
Single Crystalline Pyrochlore Nanoparticles with Metallic Conduction as Efficient Bi-functional Oygen Electrocatalysts for Zn–air Batteries
Energy Environ. Sci.10 (1) 129-136 January 2017

M. O. Bamgbopa, N. Pour, Y. Shao-Horn, and S. Almheiri,
Systematic Selection of Solvent Mixtures for Non-aqueous Redox Flow Batteries – Vanadium Acetylacetonate as a Model System
Electrochimica Acta 223 (2017) 115-123 January 2017