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Computation-aided design of oxygen-ligand-steered single-atom catalysts: Sewing unzipped carbon nanotubes File

Kim, Dong Yeon , Jeong, Da Sol , Thangavel, Pandiarajan , Ha, Miran , Hwang, Hyuntae , Park, Yoo-Jong , Shin, Tae Joo , Seo, Dong-Hwa , Shin, Hyeon Suk , Kim, Kwang S.

Article Issue Date2023-11 View178
Coordinatively Unsaturated Co Single-Atom Catalysts Enhance the Performance of Lithium-Sulfur Batteries by Triggering Strong d-p Orbital Hybridization File

Chen, Lei , Xia, Jing , Lai, Zhuangzhuang , Wu, Dandan , Zhou, Ji , Chen, Shang , Meng, Xiaodong , Wang, Zhongli , Wang, Haifeng , Zheng, Lirong , et al

Article Issue Date2024-11 View136
First-principles Density Functional Theory Elucidation of the Hydrogen Evolution Reaction on TM-promoted TiC2 (TM=Fe, Co, Ni, Cu, Ru, Rh, Pd, Ag, Os, Ir, Pt, and Au) File

Guo, Hengquan , Kang, Sung Gu , Lee, Seung Geol

Article Issue Date2023-04 View129
Growing Electrocatalytic Conjugated Microporous Polymers on Self-Standing Carbon Nanotube Films Promotes the Rate Capability of Li-S Batteries File

Jia, Yuncan , Chen, Shang , Meng, Xiaodong , Peng, Xiaomeng , Zhou, Ji , Zhang, Jiawen , Hong, Song , Zheng, Lirong , Wang, Zhongli , Bielawski, Christopher W. , et al

Article Issue Date2023-11 View113
Highly Exposed -NH2 Edge on Fragmented g-C3N4 Framework with Integrated Molybdenum Atoms for Catalytic CO2 Cycloaddition: DFT and Techno-Economic Assessment File

Wong, Kien Tiek , Brigljevic, Boris , Lee, Jeong Hyeon , Yoon, So Yeon , Jang, Seok Byum , Choong, Choe Earn , Nah, Inwook , Kim, Hyeongjun , Roh, Hyun-Seog , Kwak, Sang Kyu , et al

Article Issue Date2023-01 View139
Metal-Based Oxygen Reduction Electrocatalysts for Efficient Hydrogen Peroxide Production File

Bu, Yunfei , Ma, Rong , Wang, Yaobin , Zhao, Yunxia , Li, Feng , Han, Gao-Feng , Baek, Jong-Beom

Article Issue Date2024-12 View136
Out-of-Plane Single-Copper-Site Catalysts for Room-Temperature Benzene Oxidation File

Che, Wei , Li, Pai , Han, Gao-Feng , Noh, Hyuk-Jun , Seo, Jeong-Min , Jeon, Jong-Pil , Li, Changqing , Liu, Wei , Li, Feng , Liu, Qinghua , et al

Article Issue Date2024-05 View153
Progress in Single/Multi Atoms and 2D-Nanomaterials for Electro/Photocatalytic Nitrogen Reduction: Experimental, Computational and Machine Leaning Developments File

Singh, Aditya Narayan , Anand, Rohit , Zafari, Mohammad , Ha, Miran , Kim, Kwang S.

Article Issue Date2024-07 View168
Simple and Scalable Mechanochemical Synthesis of Noble Metal Catalysts with Single Atoms toward Highly Efficient Hydrogen Evolution File

Jin, Haiyan , Sultan, Siraj , Ha, Miran , Tiwari, Jitendra N. , Kim, Min Gyu , Kim, Kwang S.

Article Issue Date2020-06 View124
Tuning the Coordination Environment of Carbon-Based Single-Atom Catalysts via Doping with Multiple Heteroatoms and Their Applications in Electrocatalysis File

Qi, Zhijie , Zhou, Yan , Guan, Runnan , Fu, Yongsheng , Baek, Jong-Beom

Article Issue Date2023-09 View101
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