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Catalysis

Working Paper

Ab Initio Molecular Dynamics Reveals New Active Sites in Atomically Dispersed Pt1/TiO2 Catalysts

Nicholas Humphrey, Selin Bac, Shaama Mallikarjun Sharada

Version 1 posted 17 April 2020

451

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Catalysis

Working Paper

Ultra-Low Amounts of Palladium (0.005-0.05 Wt% Pd) Supported on Titania: Remarkable Low-Temperature Activity for NO Reduction with CO and Structure-Function Property Relationships in Methane Oxidation

Konstantin Khivantsev, Libor Kovarik, Nicholas R. Jaegers, János Szanyi, Yong Wang

Version 1 posted 29 December 2020

867

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3

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Catalysis

Working Paper

Computational Discovery of Codoped Single-Atom Catalysts for Methane-to-Methanol Conversion

Haojun Jia, Chenru Duan, Ilia Kevlishvili, Aditya Nandy, Mingjie Liu, Heather Kulik

Version 1 posted 17 November 2023

360

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Theoretical and Computational Chemistry

Working Paper

Active learning accelerated exploration of single-atom local environments in multimetallic systems for oxygen electrocatalysis

Hoje Chun, Jaclyn Lunger, Jeung Ku Kang, Rafael Gómez-Bombarelli, Byungchan Han

Version 1 posted 14 March 2024

400

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Catalysis

Working Paper

Identification of the catalytically dominant iron environment in iron- and nitrogen-doped carbon catalysts for the oxygen reduction reaction

Lingmei Ni, Charlotte Gallenkamp, Stephan Wagner, Eckhard Bill, Vera Krewald, Ulrike I. Kramm

Version 1 posted 10 May 2022

428

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Catalysis

Review

Challenges and opportunities for exploiting the role of zeolite confinements for the selective hydrogenation of acetylene

Jenna Vito, Manish Shetty

Version 1 posted 21 July 2023

220

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Catalysis

Working Paper

Coordination environments of platinum single atom catalysts from NMR fingerprints

Jonas Koppe, Alexander V. Yakimov, Domenico Gioffrè, Marc-Eduard Usteri, Thomas Vosegaard, Guido Pintacuda, Anne Lesage, Andrew J. Pell, Sharon Mitchell, Javier Pérez-Ramírez, Christophe Copéret

Version 1 posted 24 July 2024

309

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Catalysis

Working Paper

Electron Tug Effect in Ni Single Atoms for Carbon Dioxide Electroreduction over a Wide Potential Range

Xu Han, Ting Zhang, Martí Biset-Peiró, Chaoyue Zhang, Ke Xiao, Pengfei Cao, Marc Heggen, Weiqiang Tang, Miquel Vega-Paredes, Alba Garzón-Manjón, Lirong Zheng, Rafal E. Dunin-Borkowski, Andreu Cabot, Kim Daasbjerg, Joan R. Morante, Jordi Arbiol

Version 1 posted 08 December 2023

270

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Materials Chemistry

Working Paper

Self-Adapting Graphitic C6N6-Based Copper Single-Atom Catalyst for Smart Biosensors

Qing Hong, Hong Yang, Yanfeng Fang, Wang Li, Caixia Zhu, Zhuang Wang, Sicheng Liang, Xuwen Cao, Zhixin Zhou, Yanfei Shen, Songqin Liu, Yuanjian Zhang

Version 2 posted 05 December 2022

328

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Catalysis

Working Paper

Reaching the Fundamental Limitation in CO2 Reduction to CO with Single Atom Catalysts

Saurav Chandra Sarma, Jesus Barrio, Alexander Bagger, Angus Pedersen, Mengjun Gong, Hui Luo, Mengnan Wang, Silvia Favero, Chang-Xin Zhao, Qiang Zhang, Anthony Kucernak, Maria-Magdalena Titirici, Ifan Stephens

Version 1 posted 09 January 2023

651

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Refine Search

14 results in Single atom catalysts in Keywords: Single atom catalysts

Ab Initio Molecular Dynamics Reveals New Active Sites in Atomically Dispersed Pt1/TiO2 Catalysts

Ultra-Low Amounts of Palladium (0.005-0.05 Wt% Pd) Supported on Titania: Remarkable Low-Temperature Activity for NO Reduction with CO and Structure-Function Property Relationships in Methane Oxidation

Computational Discovery of Codoped Single-Atom Catalysts for Methane-to-Methanol Conversion

Active learning accelerated exploration of single-atom local environments in multimetallic systems for oxygen electrocatalysis

Identification of the catalytically dominant iron environment in iron- and nitrogen-doped carbon catalysts for the oxygen reduction reaction

Challenges and opportunities for exploiting the role of zeolite confinements for the selective hydrogenation of acetylene

Coordination environments of platinum single atom catalysts from NMR fingerprints

Electron Tug Effect in Ni Single Atoms for Carbon Dioxide Electroreduction over a Wide Potential Range

Self-Adapting Graphitic C6N6-Based Copper Single-Atom Catalyst for Smart Biosensors

Reaching the Fundamental Limitation in CO2 Reduction to CO with Single Atom Catalysts

14 results in Keywords: Single atom catalysts