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11 ta ish

Ish: Influence mechanism of leaching agent anions on the leaching of aluminium impurities in ionic-type rare earth ores: A DFT simulation combined with experimental verification

  1. Engineering a Z-scheme ZnFe2O4/BiVO4@MXene composite for superior photocatalytic performance: Mechanistic, DFT, and toxicity insights

    Marwa H. Abdallah, Ali B.M. Ali, Y.M. Fahmy +6

    MaqolaAdvanced Photocatalysis TechniquesSeparation and Purification Technology20251 iqtibos
    ABI

  2. Study the effect of functional groups on the oxygen reduction reaction (ORR) of graphyne as a promising electrocatalyst in protons exchange membrane fuel cell

    Ali B.M. Ali, Thanaa Amir Ahmed, Shaxnoza Saydaxmetova +7

    MaqolaElectrocatalysts for Energy ConversionJournal of Physics and Chemistry of Solids20251 iqtibos
    ABI

  3. Computational exploration of transition metal mononitrides (MN: HfN, NbN, TaN, VN, and ZrN) anchored fullerenes (MN@C60) as electrocatalysts for hydrogen evolution reaction

    Chou‐Yi Hsu, Ali B.M. Ali, Zainab Jamal Hamooda +7

    MaqolaMachine Learning in Materials ScienceInternational Journal of Hydrogen Energy20250 iqtibos
    ABI

  4. Introducing a new type of boron nitride allotrope 2D monolayer high-performance anode for magnesium batteries

    Rassol Hamed Rasheed, Ammar Kh. Hammad, Egambergan Khudoynazarov +8

    MaqolaAdvancements in Battery MaterialsJournal of Photochemistry and Photobiology A Chemistry20250 iqtibos
    ABI

  5. A computational investigation of monolayer HB: Effective NH3 gas sensor with highly sensor response

    Ali B.M. Ali, Ehab Yassen Theab, Muyassar Norberdiyeva +8

    MaqolaGas Sensing Nanomaterials and SensorsComputational Biology and Chemistry20250 iqtibos
    ABI

  6. Enhancing H2S detection: the role of Al doping concentration in the electronic properties of ZnO nanocages

    Qusay Rasheed Al-Amir, Abdulrahman T. Ahmed, Prakash Kanjariya +7

    MaqolaGas Sensing Nanomaterials and SensorsChemical Physics Letters20250 iqtibos
    ABI

  7. Using DFT to explore the sensitivity of pure and vacancy-defected BC6N monolayer towards formaldehyde gas

    Chou‐Yi Hsu, Ehab Yassen Theab, Shaxnoza Saydaxmetova +8

    MaqolaBoron and Carbon Nanomaterials ResearchColloids and Surfaces A Physicochemical and Engineering Aspects20250 iqtibos
    ABI

  8. Investigating the capacity of Co-doped BN-yne in catalyzing the dissociation of carbon dioxide through density functional theory computations

    Ali B.M. Ali, Narinderjit Singh Sawaran Singh, Luma Hussain Saleh +8

    MaqolaCarbon dioxide utilization in catalysisJournal of the Indian Chemical Society20250 iqtibos
    ABI

  9. Density functional theory investigation of pure and doped boron nitride nanoclusters for ultrasensitive detection of colorectal cancer biomarkers in exhaled breath

    Chou-Yi Hsu, Ammar Kh Hammad, Gulnoza Burkhanova +8

    MaqolaGas Sensing Nanomaterials and SensorsMaterials Chemistry and Physics20250 iqtibos
    ABI

  10. A DFT study for evaluation of the electrochemical performance of hydrogen boride monolayer as anode for Mg-ion battery

    Uday Abdul‐Reda Hussein, Ammar Kh. Hammad, Shaxnoza Saydaxmetova +7

    MaqolaAdvancements in Battery MaterialsJournal of Energy Storage20250 iqtibos
    ABI

  11. High-performance visible-light photocatalyst based on IL-modified Bi2MoO6 with MXene charge mediation and MIL-100(Fe) adsorptive oxidation for broad-spectrum aqueous remediation

    Narinderjit Singh Sawaran Singh, Ali B.M. Ali, Mumtaj Shah +6

    MaqolaAdvanced Photocatalysis TechniquesSurfaces and Interfaces20250 iqtibos
    ABI