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97 ta ish

Ish: Highly efficient lanthanum- and actinium-doped B6/B8 complexes as single-atom catalysts toward superior hydrogen evolution reaction: a DFT perspective

  1. The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors

    Samuel Francis Boys, Fernando Bernardi

    Maqola197030 iqtibos
    ABI

  2. Silicon Carbide Based Nanotubes as a Sensing Material for Gaseous H2SiCl2

    Mohsen Doust Mohammadi, Hewa Y. Abdullah, Somnath Bhowmick +1

    Maqola20226 iqtibos
    ABI

  3. Scrutinization of late first-row transition metals decorated octagonal boron (B8) ring complexes as single-atom catalysts for green hydrogen and oxygen production

    Naveen Kosar, Tariq Mahmood, Muhammad Arshad +2

    MaqolaOchiq kirishElectrocatalysts for Energy ConversionRSC Advances20255 iqtibos
    ABI

  4. Single‐Atom Catalysts: A Sustainable Pathway for the Advanced Catalytic Applications

    Baljeet Singh, Vikas Sharma, Rahul P. Gaikwad +3

    Sharh maqolaOchiq kirish20214 iqtibos
    ABI

  5. Exploration of hydrogen evolution reaction (HER) by using first row transition metals doped B6 complexes as support materials

    Naveen Kosar, Tariq Mahmood, Abdulrahman Allangawi +2

    MaqolaMachine Learning in Materials ScienceInorganic Chemistry Communications20243 iqtibos
    ABI

  6. Modulating electronic structure of metal-organic frameworks by introducing atomically dispersed Ru for efficient hydrogen evolution

    Yamei Sun, Ziqian Xue, Qinglin Liu +7

    MaqolaOchiq kirish20213 iqtibos
    ABI

  7. Precious Metal Free Hydrogen Evolution Catalyst Design and Application

    Anders Agentoft Feidenhans'l, Yagya N. Regmi, Chao Wei +3

    Sharh maqolaOchiq kirish20243 iqtibos
    ABI

  8. High-Temperature Gas Sensor Based on Novel Pt Single Atoms@SnO<sub>2</sub> Nanorods@SiC Nanosheets Multi-heterojunctions

    Lian Sun, Bing Wang, Yingde Wang

    Maqola20203 iqtibos
    ABI

  9. The adsorption of bromochlorodifluoromethane on pristine and Ge-doped silicon carbide nanotube: a PBC-DFT, NBO, and QTAIM study

    Mohsen Doust Mohammadi, Hewa Y. Abdullah

    Maqola20203 iqtibos
    ABI

  10. Directly anchoring non-noble metal single atoms on 1T-TMDs with tip structure for efficient hydrogen evolution

    Wenda Zhou, Zhenzhen Jiang, Mingyue Chen +7

    Maqola20213 iqtibos
    ABI

  11. Sarlavhasiz

    Boshqa3 iqtibos
    ABI

  12. Single-Atom Catalysts Based on the Metal–Oxide Interaction

    Rui Lang, Xiaorui Du, Yike Huang +7

    Sharh maqola20203 iqtibos
    ABI

  13. High Durability of Fe–N–C Single‐Atom Catalysts with Carbon Vacancies toward the Oxygen Reduction Reaction in Alkaline Media

    Hao Tian, Ailing Song, Peng Zhang +9

    MaqolaOchiq kirish20232 iqtibos
    ABI

  14. Systematic ab initio investigation of bare boron clusters:mDetermination of the geometryand electronic structures of<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">B</mml:mi></mml:mrow><mml:mrow><mml:mi mathvariant="normal">n</mml:mi></mml:mrow></mml:msub></mml:mrow></mml:math>(n=2–14)

    Ihsan Boustani

    Maqola19972 iqtibos
    ABI

  15. Atmospheric implications of hydration on the formation of methanesulfonic acid and methylamine clusters: A theoretical study

    Dongping Chen, Danfeng Li, Changwei Wang +3

    Maqola20192 iqtibos
    ABI

  16. Carbon-Based Single-Atom Catalysts for Advanced Applications

    Manoj B. Gawande, Paolo Fornasiero, Radek Zbořil

    Maqola20202 iqtibos
    ABI

  17. Single‐Atom Catalysts for Electrocatalytic Applications

    Qiaoqiao Zhang, Jingqi Guan

    Maqola20202 iqtibos
    ABI

  18. Hydrogen evolution/spillover effect of single cobalt atom on anatase TiO2 from first-principles calculations

    Kang Yang, Gang Zhou

    Maqola20202 iqtibos
    ABI

  19. Ab Initio Investigation of the Hydrogen Interaction on Two Dimensional Silicon Carbide

    Phi Minh Nguyen, Hoa Van Nguyen, Vi Toan Lam +3

    Maqola20222 iqtibos
    ABI

  20. Heteronanostructures constructed from vertical MoS2 nanosheets on sepiolite nanofibers boosting electrocatalytic hydrogen evolution

    Kang Peng, Jingying Ye, Linjie Zuo +6

    Maqola20232 iqtibos
    ABI

  21. Rare Earth Single-Atom Catalysts for Nitrogen and Carbon Dioxide Reduction

    Jieyuan Liu, Xue Jun Kong, Lirong Zheng +3

    Maqola20202 iqtibos
    ABI

  22. High-throughput screening of transition metal single-atom catalyst anchored on Janus MoSSe basal plane for hydrogen evolution reaction

    Chengwei Xiao, Rongjian Sa, Zuju Ma +5

    Maqola20212 iqtibos
    ABI

  23. Electrocatalytic activity of metal encapsulated, doped, and engineered fullerene-based nanostructured materials towards hydrogen evolution reaction

    Hitler Louis, Onyinye J. Ikenyirimba, Tomsmith O. Unimuke +3

    Maqola20222 iqtibos
    ABI

  24. Investigation of the adsorption and sensor properties of resorcinol (RSL) on X9N9 (X = Al, B, Ga, In) nanorings by DFT and QTAIM analysis with solvent effects

    Jamelah S. Al‐Otaibi, Y. Sheena Mary, Y. Shyma Mary +2

    Maqola20242 iqtibos
    ABI

  25. Ir Single Atom Catalyst Loaded on Amorphous Carbon Materials with High HER Activity

    Chunxiang Liu, Ganghuo Pan, Nianjie Liang +3

    Maqola20222 iqtibos
    ABI