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2024
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2018
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2024

Eliminating Redox-Mediated Electron Transfer Mechanisms on a Supported Molecular Catalyst Enables CO2 Conversion to Ethanol

M. Abdinejad, A. Farzi, R. Möller-Gulland, F. Mulder, C. Liu, J. Shao, J. Biemolt, M. Robert, A. Seifitokaldani*, T. Burdyny *

Nature Catalysis, (2024), https://doi.org/10.1038/s41929-024-01225-1

Heterogeneous Electrosynthesis of C–N, C–S and C–P Products Using CO2 as a Building Block

J. Li, H. Heidarpour, G. Gao, M. McKee, H. Bemana, Y. Zhang, C-T. Dinh*, A. Seifitokaldani*, N. Kornienko*

Nature Synthesis, (2024), https://doi.org/10.1038/s44160-024-00530-8

Copper Nanoclusters: Selective CO2 to Methane Conversion Beyond 1 A/cm²

M. Salehi, H. Al-Mahayni, A. Farzi, M. McKee, S. Kaviani, E. Pajootan, R. Lin, N. Kornienko, A. Seifitokaldani*

Applied Catalysis B: Environment and Energy, 353 (2024), 124061

Electrokinetic Analyses Uncover the Rate‐Determining Step of Biomass‐Derived Monosaccharide Electroreduction on Copper

G. Ma, H. Al-Mahayni, N. Jiang, D. Song, B. Qiao, Z. Xu, A. Seifitokaldani, S. Zhao, Z. Liang

Angewandte Chemie (2024), e202401602

Efficient Integration of Carbon Dioxide Reduction and 5 Hydroxymethylfurfural Oxidation at High Current Density

R. Lin, H. Yang, H. Zheng, M. Salehi, A. Farzi, P. Patel, X. Wang, J. Guo, K. Liu, Z. Gao, X. Li, A. Seifitokaldani*

RSC Sustainability (2024), 2, 445-458

Multi‐metallic Layered Catalysts for Stable Electrochemical CO2 Reduction to Formate and Formic Acid

T. Nguyen, B. Nourmohammadi Khiarak, Z. Xu, A. Farzi, S. Sadaf, A. Seifitokaldani*, C.T. Dinh*

ChemSusChem (2024), e202301894

2023

Electrochemical Formation of C–S Bonds from CO2 and Small-Molecule Sulfur Species

J. Li, H. Al-Mahayni, D. Chartrand, A. Seifitokaldani*, N. Kornienko*

Nature Synthesis 2 (2023) 8, 757-765

Reversible Transition of an Amorphous Cu-Al Oxyfluoride into a Highly Active Electrocatalyst for NO3− Reduction to NH3

A. Guiet, A. Simonin, H. Bemana, H. Al-Mahayni, J. Li, K. Kuruvinashetti, R. Moury, A. Hémon-Ribaud, D. Chartrand, V. Maisonneuve, J. Lhoste, A. Seifitokaldani, D. Rochefort, N. Kornienko

Chem Catalysis 3 (2023) 5, 100595

High-Density Cobalt Single-Atom Catalysts for Enhanced Oxygen Evolution Reaction

P. Kumar, K. Kannimuthu, A. S. Zeraati, S. Roy, X. Wang, X. Wang, S. Samanta, K. A Miller, M. Molina, D. Trivedi, J. Abed, M.A.C. Mata, H. Al-Mahayni, J. Baltrusaitis, G. Shimizu, Y.A. Wu, A. Seifitokaldani, E.H. Sargent, P.M. Ajayan, J. Hu, Md.G. Kibria

Journal of the American Chemical Society, 145 (2023), 14, 8052–8063

Kraft Lignin Electro-Oxidation under Ambient Temperature and Pressure

J. Han, R. Lin, M. Salehi, A. Farzi, A. Carkner, K. Liu, O. Abou El-Oon, O. Ajao, A. Seifitokaldani*

Energies 16 (2023), 24, 8007

Impact of Temperature an Order of Magnitude Larger Than Electrical Potential in Lignin Electrolysis with Nickel

A. Carkner, I. Tageldin, J. Han, A. Seifitokaldani*, J. Kopyscinski*

ChemSusChem (2023), 17, e202300795

Effective Electro-Oxidation of Hydroxymethylfurfural using the Electrografted Immobilized Aminoxyl Radical

J. Guo, M. Abdinejad, A. Farzi, M. Salehi, A. Seifitokaldani*

Energy Advances (2023) 2, 887-885

Exploration of Optimal Reaction Conditions on Lactic Acid Production from Glucose Photoreforming over Carbon Nitride

H. Zhao, X. Wang, X. Wu, J. Wang, N. Zhong, A. Seifitokaldani, S. Larter, Md. Kibria, J. Hu

Resources Chemicals and Materials 2 (2023) 2, 111-116

2022

Electroreduction of Carbon Dioxide to Acetate using Heterogenized Hydrophilic Manganese Porphyrins

M. Abdinejad, T. Yuan, K. Tang, S. Duangdangchote, A. Farzi, H.P.I. Montfort, M. Li, J. Middelkoop, M. Wolff, A. Seifitokaldani, O. Voznyy*, T. Burdyny*

Chemistry – A European Journal e202203977 (2022) 1-7

Photocatalytic Production of Hydrogen Peroxide at High Throughput

H. Yarahmadi,  A. Seifitokaldani*

Chem Catalysis 2 (2022) 7, 1515-1516

High Oxidation State Enabled by Plated Ni-P Achieves Superior Electrocatalytic Performance for 5-Hydroxymethylfurfural Oxidation Reaction

R. Lin, M. Salehi, J. Guo,  A. Seifitokaldani*

iScience 25 (2022) 8, 104744

Selective C3–C4 Cleavage via Glucose Photoreforming under the Effect of Nucleophilic Dimethyl Sulfoxide

J. Wang, X. Wang, H. Zhao, J.F.V. Humbeck, B.N. Richtik, M.R. Dolgos, A. Seifitokaldani*, M.G. Kibria*, J. Hu*

ACS Catalysis, 12 (2022) 22, 14418-14428

CO2 Electrolysis via Surface-Engineering Electrografted Pyridines on Silver Catalysts

M. Abdinejad, E. Irtem, A. Farzi, M. Sassenburg, S. Subramanian, H-P. I. V. Montfort, D. Ripepi, M. Li, J. Middelkoop, A. Seifitokaldani*, T. Burdyny

ACS Catalysis 12 (2022) 13, 7862-7876

Highly Efficient Water Oxidation via a Bimolecular Reaction Mechanism on Rutile Structured Mixed-Metal Oxyfluorides​

Z. Gohari-Bajestani, X. Wang, Z. Guiet, R. Moury, J-M. Grenèche, A. Hémon-Ribaud, Y. Zhang, D. Chartrand, V. Maisonneuve,  A. Seifitokaldani*, , N. Kornienko*, J. Lhoste*

Chem Catalysis 2 (2022) 5, 1114–1127

Technoeconomic and Life-Cycle Assessment for Electrocatalytic Production of Furandicarboxylic Acid​

P. Patel, D. Schwartz, X. Wang, R. Lin, O. Ajao,  A. Seifitokaldani*

ACS Sustainable Chemistry and Engineering 10 (2022) 13, 4206-4217

Promoted Self-Construction of β-NiOOH in Amorphous High Entropy Electrocatalysts for the Oxygen Evolution Reaction​

M. Han, C. Wang, J. Zhong, J. Han, N. Wang, A. Seifitokaldani, Y. Yu, Y. Liu, X. Sun, Z. Vomiero, H. Liang

Applied Catalysis B: Environmental 301 (2022) 120764

2021

Boride-Derived Oxygen-Evolution Catalysts

N. Wang, A. Xu, P. Ou, S-F. Hung, A. Ozden, Y-R. Lu, J. Abed, Z. Wang, Y. Yan, M-J. Sun, Y. Xia, M. Han, J. Han, K. Yao, F-Y. Wu, P-H. Chen, A. Vomiero, A. Seifitokaldani, X. Sun, D. Sinton, Y. Liu, E. H. Sargent, H. Liang

Nature Communications 12 (2021) 1, 1-9

Experimental Methods in Chemical Engineering: Density Functional Theory—DFT

H. Al‐Mahayni, X. Wang, J-P. Harvey, G. S Patience, A. Seifitokaldani*

The Canadian Journal of Chemical Engineering 99 (2021) 9, 1885-1911

Electrochemical CO2 Reduction to Ethanol: From Mechanistic Understanding to Catalyst Design

T. N. Nguyen, J. Guo, A. Sachindran, F. Li*, A. Seifitokaldani*, C-T. Dinh*

Journal of Materials Chemistry A 9 (2021) 21, 12474-12494 

2020

Fundamentals of Electrochemical CO2 Reduction on Single-Metal-Atom Catalysts

T. N. Nguyen, M. Salehi, Q. V. Le, A. Seifitokaldani*, C-T. Dinh*

ACS Catalysis 10 (2020) 17, 10068–10095

High-Valent Nickel Promoted by Atomically Embedded Copper for Efficient Water Oxidation

M. Han, N. Wang, B. Zhang, Y. Xia, J. Li, J. Han, K. Yao, C. Gao, C. He, Y. Liu, Z. Wang, A. Seifitokaldani, X. Sun, H. Liang

ACS Catalysis 10 (2020) 17, 9725–9734

DFT Analysis of Ethanol Electro-Oxidation on Fe(110) and Fe3C(110) and its Correlation with the Stress Corrosion Cracking of Carbon Steel

A. Ashrafriahi, A. Foroozan, M. Ghaznavi, A. Seifitokaldani*, R.C. Newman

J. Electrochem. Soc. 167 (2020) 111503 

Accelerated Discovery of CO2 Electrocatalysts Using Active Machine Learning

M. Zhong, K. Tran, Y. Min, C. Wang, Z. Wang, C. T. Dinh, P. D. Luna, Z. Yu, A. S. Rasouli, P. Brodersen, S. Sun, O. Voznyy, C-S. Tan, M. Askerka, F. Che, M. Liu, A. Seifitokaldani, Y. Pang, S-C. Lo, A. Ip, Z. Ulissi, E. H. Sargent

Nature 581 (2020) 7807, 178

In Situ Spectroscopic Methods for Electrocatalytic CO2 Reduction

L. Jin, A. Seifitokaldani*

Catalysts 10 (2020) 5, 481

Electrochemical Reactors for CO2 Conversion

R. Lin, J. Guo, X. Li, P. Patel, A. Seifitokaldani*

Catalysts 10 (2020) 5, 473 

CO2 Electrolysis to Multicarbon Products at Activities Greater than 1 A.cm−2

F. P. G. Arquer, C. T. Dinh, A. Ozden, J. Wicks, C. McCallum, A. R. Kirmani, D-H. Nam, C. Gabardo, A. Seifitokaldani, X. Wang, Y. C. Li, F. Li, J. Edwards, L. J. Richter, S. J. Thorpe, D. Sinton, E. H. Sargent

Science 367 (2020), 661 

Metal–Organic Framework Derived Copper Catalysts for CO2 to Ethylene Conversion

K. Yao, Y. Xia, J. Li, N. Wang, J. Han, C. Gao, M. Han, G. Shen, Y. Liu, A. Seifitokaldani, X. Sun, H. Liang

Journal of Materials Chemistry A 8 (2020), 11117

Cascade Surface Modification of Colloidal Quantum Dot Inks Enables Efficient Bulk Homojunction Photovoltaics

M-J Choi, F. P. G. Arquer, A. H. Proppe, A. Seifitokaldani, J. Choi, J. Kim, S-W Baek, M. Liu, B. Sun, M. Biondi, B. Scheffel, G. Walters, D-H Nam, J. W. Jo, O. Ouellette, O. Voznyy, S. Hoogland, S. O. Kelly, Y. S. Jun, E. H. Sargent

Nature Communication 11 (2020), 103

2019

Catalyst Synthesis under CO2 Electroreduction Favours Faceting and Promotes Renewable Fuels Electrosynthesis

Y. Wang, Z. Wang, C. T. Dinh, J. Li, A. Ozden, Md. Kibria, A. Seifitokaldani, C-S. Tan, C. M. Gabardo, M. Luo, H. Zhou,  F. Li, Y. Lum, C. McCallum, Y. Xu, M. Liu, A. Proppe, A. Johnston, P. Todorovic, T.T. Zhuang, D. Sinton, S. O. Kelly, E. H. Sargent

Nature Catalysis (2019)

Efficient Upgrading of CO to C3 Fuel Using Asymmetric C-C Coupling Active Sites

X. Wang, Z. Wang, T.T. Zhuang, C. T. Dinh,  J. Li, D-H. Nam, F. Li, C-W. Huang, C-S. Tan, Z. Chen, M. Chi, C. M. Gabardo, A. Seifitokaldani, P. Todorovic, A. Proppe, Y. Pang, A. R. Kirmani, Y. Wang, A. H. Ip, L. J. Richter, B. Scheffel, A. Xu, S-C. Lo, S. O. Kelley, D. Sinton, E. H. Sargent

Nature Communications 10 (2019), 5186

Quantum-Dot-Derived Catalysts for CO2 Reduction Reaction

M. Liu, M. Liu, X. Wang, S. M. Kozlov, Z. Cao, P. D. Luna, M. Li, X. Qiu, K. Liu, J. Hu, C. Jia, P. Wang, H. Zhou, J. He, M. Zhong, X. Lan, Y. Zhou, Z. Wang, J. Li, A. Seifitokaldani, C. T. Dinh, H. Liang, C. Zou, D. Zhang, Y. Yang, T. S. Chan, Y. Han, L. Cavallo, T. K. Sham, B. J. Hwang, E. H. Sargent

Jule, 3 (2019) 1-16

Electrochemical CO2 Reduction into Chemical Feedstocks: From Mechanistic Electrocatalysis Models to System Design

M. D. Kibria, J. P. Edwards, C. M. Gabardo, C. T. Dinh, A. Seifitokaldani, D. Sinton, E. H. Sargent

Advanced Materials, (2019) 1807166

Electro-Optic Modulation in Hybrid Metal Halide Perovskites

Y. Gao, G. Walters, Y. Qin, B. Chen, Y. Min, A. Seifitokaldani, B. Sun, P. Todorovic, M. I. Saidaminov, A. Lough, S. Tongay, S. Hoogland, E. H. Sargent

Advanced Materials, (2019) 1808336

Enhanced Electrochemical Reduction of CO2 Catalyzed by Cobalt and Iron Amino Porphyrin Complexes

M. Abdinejad, A. Seifitokaldani, C. Dao, E. H. Sargent, X. Zhang, H. B. Kraatz

ACS Applied Energy Materials, 2(2) (2019) 1330-1335

2018

Sustained High-Selectivity CO2 Electroreduction to Ethylene via Hydroxide-Mediated Catalysis at an Abrupt Reaction Interface

C. T. Dinh†, T. Burdyny†, M. D. Kibria†, A. Seifitokaldani†, C. M. Gabardo, F. P. G. Arquer, A. Kiani, J. P. Edwards, P. D. Luna, O. Bushuyev, C. Zou, R. Q. Bermudez , Y. Pang , D. Sinton, E. H. Sargent

Science, 360 (2018) 6390, 783-787

Steering Post-C-C Coupling Selectivity Enables High Efficiency Electroreduction of Carbon Dioxide to Multi-Carbon Alcohols

T. T. Zhuang†, Z. Q. Liang†, A. Seifitokaldani†, Y. Li, P. D. Luna, T. Burdyny, F. L. Che, F. Meng, Y. Min, R. Q. Bermudez, C. T. Dinh, Y. Pang, M. Zhong, B. Zhang, J. Li, P. N. Chen, X. L. Zheng, H. Y. Liang, W. N. Ge, B. J. Ye, D. Sinton, S. H. Yu, E. H. Sargent

Nature Catalysis, 1 (2018) 421–428

Hydronium-Induced Switching Between CO2 Electroreduction Pathways

A. Seifitokaldani†, C. M. Gabardo†, T. Burdyny, C. T. Dinh, J. P. Edwards, M. D. Kibria, O. S. Bushuyev, S. Kelley, D. Sinton, E. H. Sargent

Journal of the American Chemical Society, 140 (2018) 11, 3833–3837

Copper on Nitride Enhances the Stable Electrosynthesis of Multi-Carbon Products from CO2

Z. Q. Liang†, T. T. Zhuang†, A. Seifitokaldani†, J. Li, C. W. Huang, C. S. Tan, Y. Li, P. D. Luna, C. T. Dinh, Y. Hu, Q. Xiao, P. L. Hsieh, Y. Wang, F. Li, R. Q. Bermudez, Y. Zhou, P. Chen, Y. Pang, S. C. Lo, L. J. Chen, H. Tan, Z. Xu, S. Zhao, D. Sinton, E. H. Sargent

Nature Communications, 9 (2018), 3828

Combined High Alkalinity and Pressurization Enable Efficient CO2 Electroreduction to CO

C. M. Gabardo†, A. Seifitokaldani†, J. P. Edwards†, C. T. Dinh, T. Burdyny, M. D. Kibria, C. P. O’Brien, E. H. Sargent, D. Sinton

Energy and Environmental Science, 11, (2018), 2531-2539

A Surface Reconstruction Route to High Productivity and Selectivity in CO2 Electroreduction Toward C2+ Hydrocarbons

M. D. Kibria†, C. T. Dinh†, A. Seifitokaldani†, P. D. Luna, T. Burdyny, R. Q. Bermudez, M. B. Ross, O. Bushuyev, F. P. G. Arquer, P. Yang, D. Sinton, E. H. Sargent

Advanced Materials, (2018) 1804867

Metal-Organic Frameworks Mediate Cu Coordination for Selective CO2 Electroreduction

D. H. Nam, O. Bushuyev, J. Li, P. D. Luna, A. Seifitokaldani, C. T. Dinh, F. P. G. Arquer, Y. Wang, Z. Liang, A. Proppe, C. S. Tan, P. Todorovic, O. Shekhah, C. M. Gabardo, J. W. Jo, J. Choi, M. J. Choi, S. W. Baek, J. Kim, D. Sinton, S. Kelley, M. Eddaoudi, E. H. Sargent

Journal of the American Chemical Society, 140 (2018), 36, 11378–11386

2D Metal Oxyhalide Derived Catalysts for Efficient CO2 Electroreduction

F. P. G. Arquer†, O. S. Bushuyev†, P. D. Luna†, C. T. Dinh, A. Seifitokaldani, M. I. Saidaminov, L. N. Quan, A. Proppe, Md. G. Kibria, S. Kelley, D. Sinton, E. H. Sargent

Advanced Materials, (2018) 1802858

Acid-Assisted Solution-Phase Ligand Exchange for Infrared Colloidal Quantum Dot Photovoltaics

J. W. Jo†, J. Choi†, F. P. G. Arquer†, A. Seifitokaldani, B. Sun, Y. Kim, J. Z. Fan, R. Q. Bermudez, J. Kim, M. J. Choi, S. W. Baek, A. H. Proppe, G. Walters, O. Voznyy, E. H. Sargent

Nano Letters, 18 (2018) 7, 4417–4423

Activated Electron-Transport Layers for Infrared Quantum Dot Optoelectronics

J Choi†, J. W. Jo†, F. P. G. Arquer†, Y. B. Zhao, B. Sun, J. Kim, M. J. Choi, S. W. Baek, A. H. Proppe, A. Seifitokaldani, D. H. Nam, P. Li, O. Ouellette, Y. Kim, O. Voznyy, S. Hoogland, Z. Lu, E. H. Sargent

Advanced Materials, (2018) 1801720

2017

ELSI: A Unified Software Interface for Kohn-Sham Electronic Structure Solvers

V. W. Yu, F. Corsetti, A. García, W. P. Huhn, M. Jacquelin, W. Jia, B. Lange, L. Lin, J. Lu, W. Mi, A. Seifitokaldani, Á. V. Mayagoitia, C. Yang, H. Yang, V. Blum

Computer Physics Communications, 222 (2018) 267-285

2016

Important Variation in Vibrational Properties of LiFePO4 and FePO4 Induced by Magnetism

A. Seifitokaldani, A. E. Gheribi, A.T. Phan, P. Chartrand and M. Dollé

Scientific Reports, 6 (2016) 33033

On the Limitation of Density Functional Theory (DFT) for Treatment of the Anharmonicity in Metals

A. Seifitokaldani, A. E. Gheribi and M. Dollé

Solid State Communications, 247 (2016) 78-81

Thermophysical Properties of Titanium and Vanadium Nitrides: Thermodynamically Self-Consistent Approach Coupled with Density Functional Theory

A. Seifitokaldani, A. E. Gheribi, M. Dollé and P. Chartrand

Journal of Alloys and Compounds, 662 (2016) 240-251

2015

Thermodynamically Self-Consistent Method to Predict Thermophysical Properties of Ionic Oxides

A. Seifitokaldani and A. E. Gheribi

Computational Materials Science, 108 (2015) 17-26

Stability and Catalytic Activity of Titanium Oxy-Nitride Catalyst Prepared by In-Situ Urea-Based Sol-Gel Method for the Oxygen Reduction Reaction (ORR) in Acid Medium

A. Seifitokaldani, M. Perrier, O. Savadogo

International Journal of Hydrogen Energy, 40 (2015) 10427-10438

Electrochemically Stable Titanium Oxy-Nitride Support for Platinum Electro-Catalyst for PEM Fuel Cell Applications

A. Seifitokaldani, O. Savadogo, M. Perrier

Electrochimica Acta, 167 (2015) 237-24

Electrochemical and Physicochemical Properties of Titanium Oxy-Nitride (TiON) Electrocatalyst Prepared by Sol-Gel Methods for the Oxygen Reduction Reaction (ORR) Purposes

A. Seifitokaldani, K. Oishi, M. Perrier, O. Savadogo

Journal of Solid State Electrochemistry, 19 (2015) 3097–3109

An ab initio Method for the Prediction of the Lattice Thermal Transport Properties of Oxide Systems: Case Study of Li2O and K2O

A. E. Gheribi, A. Seifitokaldani, P. Wu and P. Chartrand

Journal of Applied Physics, 118 (2015) 145101

2014

Density Functional Theory (DFT) Computation of the Oxygen Reduction Reaction (ORR) on Titanium Nitride (TiN) Surface

A. Seifitokaldani, O. Savadogo, M. Perrier

Electrochimica Acta, 141 (2014) 25-32

Oxygen Reduction Reaction (ORR) on a Mixed Titanium and Tantalum Oxy-nitride Catalyst Prepared by the Urea-based Sol-Gel Method

A. Seifitokaldani, M. Perrier, O. Savadogo

Journal of New Materials for Electrochemical Systems, 17 (2014) 055-065

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