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Improved Activity and Durability of Carbon-Capped Pd and PdNi Catalysts─From Model Active Layers to Anion-Exchange Membrane Fuel Cell Electrodes ACS Catal. (IF 11.3) Pub Date : 2025-05-16 Ricardo Sgarbi, Huong Doan, Simon Amigues, Nicolas Bibent, Vincent Martin, Viktoriia Zemtsova, Frédéric Jaouen, Julien Thuilliez, Marian Chatenet
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H-Bond-Assisted Cleavage of N–O Bond in the Electrochemical Reduction of N2O Catalyzed by Iron Tetraphenylporphyrin ACS Catal. (IF 11.3) Pub Date : 2025-05-16 Céline Naddour, Rana Deeba, Camille Chartier, Emmanuel Nicolas, Sylvie Chardon-Noblat, Cyrille Costentin
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Selective Reverse Water–Gas Shift Reaction through MnOx Modification of Supported Pd Catalysts ACS Catal. (IF 11.3) Pub Date : 2025-05-16 Shimpei Naniwa, Shintaro Oka, Shoji Iguchi, Kentaro Teramura
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Ruthenium-Based Nanoparticles-Loaded Layered Silica Nanosheets-Assembled Stacked-Structure Nanoreactors for Efficient Production of Biomass-Based Pyrrolidinones ACS Catal. (IF 11.3) Pub Date : 2025-05-16 Jingfei Wang, Xuebin Lu, Yuanyu Wang, Zekun Sun, Run Jing, Zhihao Yu
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Amorphous LiNxHy Boosts Low-Temperature Ammonia Decomposition over the Co/MgO Catalyst ACS Catal. (IF 11.3) Pub Date : 2025-05-16 Peijie Han, Yankun Du, Huiying Yang, Ning Yan
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Gas–Liquid Interface Effects on a One-Pot Two-Enzyme Biocatalytic Oxidation Systems ACS Catal. (IF 11.3) Pub Date : 2025-05-16 Jingyu Wang, Elif Erdem, Luca Schmermund, Xiaodong Liang, Volker Sieber, John M. Woodley
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Electrocatalysts for the Oxygen Reduction Reaction in Proton Exchange Membrane Fuel Cells: Significant Advances, Major Challenges, and Future Directions ACS Catal. (IF 11.3) Pub Date : 2025-05-16 Sami Mohammed Alfaifi, Rajkamal Balu, Ken Chiang, Namita Roy Choudhury, Naba K. Dutta
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A Minimal Mutation Trajectory Separates Inverting and Retaining Mechanisms on the Same Sialidase Structural Scaffold ACS Catal. (IF 11.3) Pub Date : 2025-05-16 Michael Jakob Pichler, Marina Corbella, Sebastian Meier, Maria Haugaard Bohl Andersen, Tine Sofie Nielsen, Sanchari Banerjee, Jens Preben Morth, Carme Rovira, Maher Abou Hachem
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Transforming Boron Carbon Nitride: A Carbon-to-Oxygen Switch to Boost Propane Oxidative Dehydrogenation ACS Catal. (IF 11.3) Pub Date : 2025-05-16 Xinping Zhang, Bohua Ren, Zhenzhen Yang, Hao Chen, Sheng Dai
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NHC-Catalyzed Kinetic Resolution for the Synthesis of Boron-Stereogenic BODIPYs ACS Catal. (IF 11.3) Pub Date : 2025-05-16 Yuan-Yuan Gao, Yu-Jing Liang, Gaowei Li, Lu Li, Zhi-Yuan Hu, Wen-Hao Lin, Xue-Hui Huang, Yu Chen, Xuzhao Du, Peiyuan Yu, Qiuling Song, Lantao Liu
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Electro-Bendable Metal–Organic Framework Nanosheets Enable Durable Electrocatalytic Water Oxidation at 1 A/cm2 ACS Catal. (IF 11.3) Pub Date : 2025-05-16 Yuanwu Liu, Lirong Wang, Congcong Liu, Johannes Kresse, Marielle Deconinck, René Hübner, Daria Mikhailova, Yana Vaynzof, Xiaoming Zhang, Alexander Eychmüller
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Exsoluted Ni from Hexaaluminates for COx Free Hydrogen and Carbon Nanotubes via the Catalytic Decomposition of Methane ACS Catal. (IF 11.3) Pub Date : 2025-05-15 Samuel B. Portillo, Mohammadreza Kosari, Kunran Yang, Andrew Pedersen, Elizabeth Nguyen, Abhijit Talpade, Fanxing Li
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Reversed pH Dependence Behavior in Alkaline Environments for Hydrogen Evolution Reaction ACS Catal. (IF 11.3) Pub Date : 2025-05-15 Ming Gong, Dongxu Jiao, Peng Li, Jinchang Fan, Lei Zhang, Yanchao Xu, Wei Zhang, Weitao Zheng, Dewen Wang, Shengli Chen, Xiaoqiang Cui
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Engineering Limonene Epoxide Hydrolases for the Enantiocomplementary Synthesis of Chiral 1,3-Diols and Oxetanes ACS Catal. (IF 11.3) Pub Date : 2025-05-15 Zhouzhou Zhao, Junkuan Li, Congcong Li, Ge Qu, Bo Yuan, Lei Chen, Zhoutong Sun
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Nitrogenase-Inspired Vs-MoS2/Vo-Fe2O3 Heterojunction with Fixed Molar Ratio Promotes Bifunctional Nitrogen Fixation ACS Catal. (IF 11.3) Pub Date : 2025-05-15 Xinyu Chen, Shuang Wu, Jikang Wang, Bo Li, Lian Xiao, Jia-Qi Lv, Qianqian Liu, Yunzuo Cui, Jianxin Ma, Weibo Ren, Yufei Zhao, Li-Kai Yan, Jia-Wei Wang, Hong-Ying Zang
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Fe(III)–H2O2 as an Alternative Oxidant for Catalytic Sulfoxidation in Cytochrome P450 Enzymes: Combined Theoretical and Experimental Evidence ACS Catal. (IF 11.3) Pub Date : 2025-05-15 Musen Li, Langxing Liao, Zhihui Jiang, Zongyu Bao, Shengbiao Ji, Binju Wang
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Correction to “Using Enzymes for Catalysis under Industrial Conditions” ACS Catal. (IF 11.3) Pub Date : 2025-05-15 Elif Erdem, John M. Woodley
Here we would like to correct the text because UPO enzyme does not require FAD regeneration. Published: “Without efficient cofactor recycling, high TTNs become economically unsustainable. For instance, unspecific peroxygenase (UPO) from Agrocybe aegerita requires effective FAD regeneration to maintain cost-effective large-scale oxyfunctionalization.” Correction: “Without efficient cofactor recycling
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Reaction Mechanism and Catalytic Determinants of a Highly Active De Novo Metalloesterase ACS Catal. (IF 11.3) Pub Date : 2025-05-14 Luís M. C. Teixeira, João T. S. Coimbra, Maria J. Ramos, Donald Hilvert, Pedro A. Fernandes
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Boosting Energy Flow by Manipulating Core–Satellite Dielectric Function Ratio of Heterostructures for Efficient Plasmon-Enhanced Ammonia Borane Dehydrogenation ACS Catal. (IF 11.3) Pub Date : 2025-05-14 Xiangxiang Zhang, Min Lv, Bei Li, Zeyan Wang, Yuanyuan Liu, Peng Wang, Hefeng Cheng, Ying Dai, Baibiao Huang, Zhaoke Zheng
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Molecular Regulator in Mordenite-Catalyzed DME Carbonylation: Eliminating Deactivation Sites, Modulating Microenvironments, and Enhancing Activity ACS Catal. (IF 11.3) Pub Date : 2025-05-14 Shengying Zhao, Hailun Geng, Tao Zhang, Minghui Tan, Jie Yao, Jiaqi Fan, Zhongbo Zhou, Tiecheng Shang, Wenzhong Shen, Guohui Yang, Noritatsu Tsubaki
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Exploring Electrochemical C(sp3)–H Oxidation over Fe Complexes: Ligand Effect on the Rate–Bond Dissociation Energy Relationship and Reaction Mechanism ACS Catal. (IF 11.3) Pub Date : 2025-05-14 Yu-Wei Chuang, Kuan-Yu Lu, Chien-Wen Lin, Yung-Ching Yang, Yun-Jou Tseng, Hao-Ting Chang, Ting-Yee Chuang, Tzuhsiung Yang, I-Chung Lu, Yu-Heng Wang
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AI Approaches to Homogeneous Catalysis with Transition Metal Complexes ACS Catal. (IF 11.3) Pub Date : 2025-05-14 Lucía Morán-González, Arron L. Burnage, Ainara Nova, David Balcells
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Screening of Lanthanum-Based Perovskites for the Oxygen Evolution Reaction at Industrial Conditions for Alkaline Water Electrolysis ACS Catal. (IF 11.3) Pub Date : 2025-05-14 Fabian Luca Buchauer, So̷ren Bredmose Simonsen, Mie Engelbrecht Jensen, Ivano Eligio Castelli, Christodoulos Chatzichristodoulou
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Flexible Biguanide Mono- and Bimetallic Zinc Complexes for the Ring-Opening (Co)polymerization of Lactides ACS Catal. (IF 11.3) Pub Date : 2025-05-14 Benjamin Théron, Lukáš Vlk, Tomáš Chlupatý, Marie-José Penouilh, Eliška Procházková, Raluca Malacea-Kabbara, Pierre Le Gendre, Aleš Růžička
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Ruthenium Nanoparticles Anchored on Cobalt Oxide Married with Nitrogen and Phosphorus Co-Doped Carbon for Hydrolytic Dehydrogenation of Ammonia Borane ACS Catal. (IF 11.3) Pub Date : 2025-05-14 Yutong Li, Haoyue Huang, Qiuhong Wei, Shujun Qiu, Yongpeng Xia, Fen Xu, Lixian Sun, Hailiang Chu
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Hydrogen Peroxide Production with Photocatalysts Based on Carbon Nitride: Evaluation Criteria, Reaction Mechanism, Improvement Scheme, and Development Opportunity ACS Catal. (IF 11.3) Pub Date : 2025-05-14 Jiawei Song, Chen Li, Xu Zhang, Peijie Ma, Kun Zheng
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Diversity in Zwitterionic Metal Ammonium Tris(phenolate)s for the Controlled Immortal Polymerization of Lactide: Dramatic Activity Enhancement and Mechanistic Insight on Expansion beyond Zirconium ACS Catal. (IF 11.3) Pub Date : 2025-05-14 Matthew G. Davidson, Catherine J. Frankis, Matthew D. Jones, Gabriele Kociok-Köhn, Frank Marken, Strachan N. McCormick, James Tipler, Philip B. Yang
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Mechanism of Bicarbonate-Enhanced Solar Oxidation of Water to Hydrogen Peroxide over BiVO4 ACS Catal. (IF 11.3) Pub Date : 2025-05-13 Payal Chaudhary, Vitaly Alexandrov
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Revealing Catalytic Properties of Palladium/Gold Systems toward Hydrogen Evolution, Oxidation, and Absorption with Scanning Electrochemical Microscopy ACS Catal. (IF 11.3) Pub Date : 2025-05-13 Christian M. Schott, Julia Holl, Raul Zazpe, Michael Kopp, Ondřej Man, Sitaramanjaneya M. Thalluri, Jhonatan Rodriguez-Pereira, Peter M. Schneider, Kun-Ting Song, Emre Keles, Pekka Peljo, Jerzy J. Jasielec, Elena L. Gubanova, Jan M. Macak, Aliaksandr S. Bandarenka
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C–H Functionalization as a Powerful Method for Direct Synthesis of Lactones ACS Catal. (IF 11.3) Pub Date : 2025-05-13 Olivia F. Goethe, Daniel Zhou, Xiaoyu Zhu, Petr Sevelda, Alex Szyperek, Martin Tomanik
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Temperature Effects on the Surface CO Population during CO2 Electroreduction over Copper ACS Catal. (IF 11.3) Pub Date : 2025-05-13 Victor D. Brandão, Hakhyeon Song, Anush Venkataraman, Yuval Fishler, Sukaran S. Arora, Saket S. Bhargava, Carlos Villa, Adam Holewinski, Sankar Nair, Marta C. Hatzell, Carsten Sievers
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Dual-Regulation Engineering of Spinel Co3O4 via Mo Electron Buffering and Asymmetric Sites Coupling for Acidic Oxygen Evolution Reaction ACS Catal. (IF 11.3) Pub Date : 2025-05-13 Zhiwen Liu, Wenqiang Shen, Xiaolong Liang, Jing Liang, Ke Xu, Xu Ge, Jun Lu, Hongsheng Liu, Jingyi Xiao, Liang Wang, Junfeng Gao, Jinxuan Liu
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Tailoring Cu-Based Nanoalloys for Highly Selective Electrochemical Urea Synthesis from CO2 and Nitrate ACS Catal. (IF 11.3) Pub Date : 2025-05-13 Hao Zhang, Jinjie Liu, Zhihang Xu, Yuanzhi Bu, Tai-Sing Wu, Wei-Min Tu, Yun-Liang Soo, Cong Lin, Ye Zhu, Qiong Lei, Jun Yin, Tsz Woon Benedict Lo
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Overcoming Conformational Complexity to Elucidate Selective Ethylene Tetramerization Behavior ACS Catal. (IF 11.3) Pub Date : 2025-05-13 Jiale Peng, Long Chen, Mengyu Zhu, Li Sun, Zuoxiang Zeng, Zhen Liu
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Sulfenamide-Catalyzed Diastereoselective Synthesis of Epoxides in Small Molecules and Polymers ACS Catal. (IF 11.3) Pub Date : 2025-05-13 Zeyu Xu, Tianyuan Jia, Xinping Zhang, Qingjin Liang, Liang Yang, Tiezheng Jia
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Free-Energy Landscapes and Surface Dynamics in Methane Activation on Ni(511) via Machine Learning and Enhanced Sampling ACS Catal. (IF 11.3) Pub Date : 2025-05-12 Yezhi Jin, Yinan Xu, Jireh S. García Sánchez, Gustavo R. Pérez-Lemus, Pablo F. Zubieta Rico, Massimiliano Delferro, Juan J. de Pablo
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Modular Synthesis of Chiral 1,3-Diboronates with Differentiable Boryl Groups via Cu-Catalyzed Borylalkylation of Styrenes ACS Catal. (IF 11.3) Pub Date : 2025-05-12 Guoxiang Zhang, Quan-Hong Zhao, Xin-Yue Chai, Yanjie Yang, Zhuo Zhang, Kai Qu, Song Liu, Yuan Huang
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Turning Enzyme Models into Model Enzymes in a Substrate-Tailored, Desolvated Active Site ACS Catal. (IF 11.3) Pub Date : 2025-05-12 Mohan Lakavathu, Yan Zhao
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Rh-Catalyzed Cycloisomerization of 1,8-Enynes Initiated by C–C Activation: Diastereoselective Synthesis of Bicyclo[5.1.0]octene Systems ACS Catal. (IF 11.3) Pub Date : 2025-05-12 Yong-Qi Wang, Gan Hu, Deng Pan, Di Jiang, Bi-Qin Wang, Ping Hu, Genping Huang, Feijie Song
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A Practical Start-Up Guide for Synthetic Chemists to Implement Design of Experiments (DoE) ACS Catal. (IF 11.3) Pub Date : 2025-05-12 Brendan J. Wall, Mason T. Koeritz, Levi M. Stanley, Brett VanVeller
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Ultrahigh-Throughput Activity Engineering of Promiscuous Amidases through a Fluorescence-Activated Cell Sorting Assay ACS Catal. (IF 11.3) Pub Date : 2025-05-12 Ina Somvilla, Hannes Meinert, Clemens Cziegler, Tobias Gökler, Christoph F. Berner, Hannes Wolfgramm, Yannick Branson, Anne C. Conibear, Uwe Völker, Christoffel P. S. Badenhorst, Thomas Bayer, Uwe T. Bornscheuer
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Atomically Dispersed Rh–O–V Pairs Promote Methane Dry Reforming with Sustained Catalytic Activity ACS Catal. (IF 11.3) Pub Date : 2025-05-11 Yani Zhang, Ning Cao, Ke Wang, Mi Yan, Xingwang Zhang, Pengfei Xie
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Access to Nitrogen–nitrogen Bond-Containing Heterocycles Through Substrate Promiscuity of Piperazate Synthases ACS Catal. (IF 11.3) Pub Date : 2025-05-11 Yongxin Li, Angelina Osipyan, Niels A.W. de Kok, Simon Schröder, Maria Founti, Peter Fodran, Ronald van Merkerk, Artur Maier, Dirk Tischler, Sandy Schmidt
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Palladium-Catalyzed Oxy-olefination of Styrenes toward Fluoroallyl Ethers ACS Catal. (IF 11.3) Pub Date : 2025-05-11 Min Zhao, Ying Xu, Yuanhao Zhu, Yaxin Fan, Fukuan Zhang, Jian Zhang, Yaojia Jiang
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Nitroarenes as the Visible-Light-Responsive Photocatalysts for the Multimode Aerobic Oxidation ACS Catal. (IF 11.3) Pub Date : 2025-05-11 Hongji Li, Shuaige An, Jialing Ma, Xiaoting Liu, Chaofeng Zhang
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Catalyst-Controlled Divergent Cyclopropene Hydroselenation ACS Catal. (IF 11.3) Pub Date : 2025-05-11 Chen Cui, Qi Li, Zhen Wang, Yu Lu, Xiao-Hui Yang
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Benchmarking the Stability of State-of-the-Art H2O2 Electrocatalysts under Acidic Conditions ACS Catal. (IF 11.3) Pub Date : 2025-05-10 Guilherme V. Fortunato, Daniele C. Jung, Julio C. Lourenço, Pallabi Bhuyan, Ji Sik Choi, Xiangyu You, Sumin Lim, Michele Melchionna, Hikmet Sezen, Jan P. Hofmann, Paolo Fornasiero, Marcos R.V. Lanza, Marc Ledendecker
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S-Scheme Homojunction Carbon Nitride for Photocatalytic Overall Water Splitting ACS Catal. (IF 11.3) Pub Date : 2025-05-10 Guanyu Wu, Wei Zhang, Zhao Mo, Xinyu Zhao, Peipei Sun, Qiuheng Wang, Pengcheng Yan, Xiaojie She, Hui Xu
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Rationalizing the Overall H2O2 Selectivity of Metal Dichalcogenide Electrocatalysts for the Two-Electron Oxygen Reduction Reaction Using Microkinetic Modeling ACS Catal. (IF 11.3) Pub Date : 2025-05-09 Ipsita Mondal, Hongyuan Sheng, Kwanpyung Lee, Song Jin, J. R. Schmidt
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Machine Learning Enables a Top-Down Approach to Mechanistic Elucidation in Asymmetric Catalysis ACS Catal. (IF 11.3) Pub Date : 2025-05-09 Isaiah O. Betinol, Yutao Kuang, Junshan Lai, Christopher Yousofi, Jolene P. Reid
General reaction behavior is rarely reported in asymmetric catalysis, not simply because it is difficult to achieve, but also due to the methods used for its identification and study. Traditional approaches involve compartmentalization, where the impact of individual components is initially analyzed, followed by assimilation using simple response and structure matching techniques. However, extending
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Tailoring OH Formation and Desorption on Nickel Catalysts via Surface Oxidation for Enhanced Hydrogen Evolution Stability and Kinetics ACS Catal. (IF 11.3) Pub Date : 2025-05-09 Yu Kang, Chunyu Zhang, Hao Li, Yifan Li, Hao Lei, Rong Huang, Yujia Han, Wei Wei, Xunhua Zhao, Yi Cui
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In Situ Fluorescence Imaging of Oxygen Evolution on Epitaxial Perovskite Films with Composition Gradients ACS Catal. (IF 11.3) Pub Date : 2025-05-09 Daniel J. Zheng, Haldrian Iriawan, Rohit Pant, C. John Eom, Hongbin Xu, Jiayu Peng, Cat Arase, Ichiro Takeuchi, Yuriy Román-Leshkov, Yang Shao-Horn
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A Data-Science Approach to Experimental Catalyst Discovery: Integrating Exploration, Exploitation, and Serendipity ACS Catal. (IF 11.3) Pub Date : 2025-05-08 Sunao Nakanowatari, Keisuke Takahashi, Hieu Chi Dam, Toshiaki Taniike
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N Restructuring of Iron-Based Catalysts Boosting the Formation of C2+ Olefins from CO2 Hydrogenation ACS Catal. (IF 11.3) Pub Date : 2025-05-08 Zhenzhou Zhang, Lingyu Jia, Yanjia Guo, Yuqiong Li, Feixue Han, Bingbing Liao, Shanshan Dang, Fei Chen, Weifeng Tu, Xiaohu Yu, Yi-Fan Han
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Recent Advances in Metal-Catalyzed Transformations of Acylsilanes via the Activation of C–Si Bonds ACS Catal. (IF 11.3) Pub Date : 2025-05-08 Vishal Kumar Rawat, Mamoru Tobisu
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Photochemically Stable Amide-Linked Covalent Organic Framework for Efficient Dual Photoredox and Copper Catalysis ACS Catal. (IF 11.3) Pub Date : 2025-05-08 Zhibei Zhou, Yingjie Fan, Abigail L. Blenko, Zitong Wang, Wenbin Lin
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Ir-Catalyzed Regio- and Enantioselective C–H Addition to 1,1-Disubstituted Alkenes Enabled by the Directing Group: Construction of Acyclic Quaternary Stereocenters ACS Catal. (IF 11.3) Pub Date : 2025-05-08 Kentaro Yamakawa, Takahiro Nishimura
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GDE Stability in CO2 Electroreduction to Formate: The Role of Ionomer Type and Loading ACS Catal. (IF 11.3) Pub Date : 2025-05-08 Jose Antonio Abarca, Lucas Warmuth, Alain Rieder, Abhijit Dutta, Soma Vesztergom, Peter Broekmann, Angel Irabien, Guillermo Díaz-Sainz
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Competitive CO2 Electrochemical Reduction and Hydrogen Evolution at Sn Electrode through Constant-Potential First-Principles Study and Microkinetic Modeling ACS Catal. (IF 11.3) Pub Date : 2025-05-08 Wenyu Pang, Hai-Yan Su, Zhisheng Mao, Yu Shao, Xianfeng Hao, Yongchao Jia, Yuanhui Xu, Keju Sun
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From Micro-environments to Macroscopic Effects: How the Alkaline Hydrogen Evolution Reaction Drives Cu Cathodic Corrosion ACS Catal. (IF 11.3) Pub Date : 2025-05-08 Hori Pada Sarker, Anshuman Goswami, Michael T. Tang, Frank Abild-Pedersen
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