Results 171 to 180 of about 49,790 (296)

Lattice Carbon‐Mediated Ultralow‐Barrier C–C Coupling for Selective CO Electroreduction to Ethylene

Advanced Science, EarlyView.
Combined DFT and molecular dynamics simulations reveal that while the lattice carbon at the MXene edge cannot directly bind CO2 to form ethylene, it acts as an active center to promote C─C coupling between adjacent *CO intermediates for ethylene production.
Jiangke Tao, Zhichao Yu, Lulu Chen, Weng Fai Ip, Sen Lin, Hui Pan   +5 more
wiley   +1 more source

Bonding Effect of Partial Valence Band Depletion in Metallic [ZnSi] Layers of Li₂[ZnSi] and a Comparison to "White Graphene" h-BN. [PDF]

Inorg Chem
Wagner FR, Ormeci A, Schwarz U.
europepmc   +1 more source

Ion‐Confinement‐Assisted Erasure Purifies Oxidized MXene for Reuse

Advanced Science, EarlyView.
An erasure‐purification strategy removes surface‐derived TiO2 from oxidized Ti3C2Tx MXene by ion‐confinement‐induced interfacial conversion to soluble titanates, followed by brief acid washing. The scalable process enables approximately 70% material recovery, restores electrical conductivity, and recovers functional performance, including high ...
Xuefeng Zhang, Yujia Wu, Huayu Xu, Jinyi Ye, Yanfang Yang, Haohan Wu, Jiayi Lu, Hao Li, Dongxiao Kan, Jingfeng Wang, Hui Kang, Zhimin Fan   +11 more
wiley   +1 more source

The Electronic Structure of Planar Rhombic Co₂O₂. [PDF]

J Phys Chem A
Du D, Xiao N, Li X, Dimitrova M, Sundholm D, Xiong XG.   +5 more
europepmc   +1 more source

Modulation of Electronic Structure in Kraft Lignin‐Derived Mo Single‐Atom Catalysts for Optimized Electrochemical Oxygen Reduction

Advanced Science, EarlyView.
Biomass‐derived lignin is used as a sustainable precursor to synthesize Mo single atoms anchored on a nitrogen‐coordinated carbon framework. As the Mo structure transitions from MoC clusters to isolated single‐atom sites, oxygen evolution reaction (ORR) activity progressively improves.
Junbeom Park, Jaemin Park, Jun Ho Seok, Ji Soo Byun, Cheoulwoo Oh, Eung‐Dab Kim, Young‐Jin Ko, Youngeun Kim, Gawon Sim, Min Jae Kim, Hyeon‐Seok Bang, Ho Seok Park, Chun‐Jae Yoo, Sang Uck Lee, Hyung‐Suk Oh, Kwang Ho Kim, Wooseok Yang   +16 more
wiley   +1 more source

Infrared Photodissociation Spectroscopic and Theoretical Study of Mass-Selected Heteronuclear Iron-Rhodium and Iron-Iridium Carbonyl Cluster Cations. [PDF]

Molecules
Hu J, Wang X.
europepmc   +1 more source

A Universal Metal–Flavonoid Coating Strategy: Engineering Biomaterials for Diabetic Bone Regeneration

Advanced Science, EarlyView.
Construction of metal–flavonoid functionalized coatings on conventional bone repair materials. A one‐pot method is used to directly construct multifunctional metal–flavonoid coatings on the surface of traditional bone repair materials by selecting metal ions with osteogenic/angiogenic properties and flavonoids with reactive oxygen species scavenging ...
Chen Yang, Chenle Dong, Lefeng Su, Zhiqiang Liu, Lingyi Hu, Qishu Jin, Hao Chen, Chunlong Zhang, Yihao Wu, Jiang Chang, Zhaowenbin Zhang, Jiandong Yuan   +11 more
wiley   +1 more source

Hydrogenation-enriched fundamental properties of armchair silicene nanoribbons: a comprehensive first-principles study. [PDF]

RSC Adv
Hoat DM, Nhan DT, Duc VM, Truong LP, Mai TV, Dang MT, Nguyen DK.   +6 more
europepmc   +1 more source

Advances in Generalized Valence Bond-Coupled Cluster Methods for Electronic Structure Theory

, 2009
Keith V. Lawler
openalex   +1 more source

Regulating Zinc Anode Interface with an Environmental Biomass‐Derived Additive for Long‐Lifespan Aqueous Batteries

Advanced Science, EarlyView.
A biomass‐derived additive synthesized from chitin, 3‐acetylamino‐5‐acetylfuran (3A5AF), resolves key stability issues such as uncontrolled dendrite growth, hydrogen evolution reaction, and corrosion of zinc anodes by reconstructing the solvation structure of the electrolyte and protecting the anode interface. ABSTRACT Aqueous zinc‐based batteries face
Bingbo Ni, Qian Wang, Qiusheng Ma, Junhui Cheng, Xingxing Gu, Guangyin Li   +5 more
wiley   +1 more source