Skip to main content
AkademIndex

Products

For developers

AkademBaseOpen API for the ecosystem
← Back to work

Works citing this work

42 works

Work: Semiempirical GGA‐type density functional constructed with a long‐range dispersion correction

  1. T-graphene monolayer as high-performance anode for Cs-ion batteries: A DFT study

    Maher Ali Rusho, A.M. Ahmad, Prakash Kanjariya +6

    ArticleAdvancements in Battery MaterialsJournal of Physics and Chemistry of Solids20250 citations
    ABI

  2. Pd and Pt transition metal decorated WS2 nanosheets as efficient gas sensors for SOx molecules: A comparative DFT study

    Farag M. A. Altalbawy, Fadhil Faez Sead, Suranjana V. Mayani‎ +7

    Article2D Materials and ApplicationsMaterials Chemistry and Physics20250 citations
    ABI

  3. Electronic, magneto-optic and band alignments of MnO2/AlN and MnO2/SiC topological vdW hetrostructures: A DFT study

    Abdulrahman Qais Khaleel, Abhinav Kumar, Farag M. A. Altalbawy +7

    Article2D Materials and ApplicationsSolid State Communications20250 citations
    ABI

  4. 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

    ArticleCarbon dioxide utilization in catalysisJournal of the Indian Chemical Society20250 citations
    ABI

  5. Elucidating the Adsorption of Cytosine (C4H5N3O) Nucleobase on the Surface of MoSe2 Nanosheets Decorated with Os Atoms: Applications to DNA Biosensors

    Farag M. A. Altalbawy, Fadhil Faez, Prakash Kanjariya +6

    ArticleAdvanced biosensing and bioanalysis techniquesJournal of Inorganic and Organometallic Polymers and Materials20250 citations
    ABI

  6. Theoretical investigation of the adsorption behaviors of mercaptopurine drug on the Pd and Pt functionalized MoSe2 nanosheets: Applications to drug delivery systems

    Munthar Kadhim Abosaoda, Farag M. A. Altalbawy, Nikunj Rachchh +7

    Article2D Materials and ApplicationsComputational and Theoretical Chemistry20250 citations
    ABI

  7. The effect of non-stoichiometry in Sb2Se3 films on their phonon and electronic properties in the infrared range

    B. Andriyevsky, Leszek Bychto, A. Patryn +14

    ArticleChalcogenide Semiconductor Thin FilmsScientific Reports20250 citations
    ABI

  8. Uncovering the potential of two-dimensional T-BC monolayer as anode for Ca-ion batteries: A computer-based study and electrochemical properties

    Nagindar K. Singh, A.K. Hammad, Shirin Shomurotova +8

    ArticleAdvancements in Battery MaterialsJournal of Molecular Graphics and Modelling20250 citations
    ABI

  9. A General Selenium-Anchoring Strategy for the Synthesis of Subnanometer Metal Cluster Catalysts

    Weiming Chen, Jing Xia, Zhiyi Sun +7

    ArticleAsymmetric Hydrogenation and CatalysisACS Catalysis20250 citations
    ABI

  10. Selenium-Based Hetero-Circulene Monolayer: Coexistence of Massless Dirac Fermions, Heavy Fermions and Semiconductivity in a Single Quantum Platform with Lithium-Ion Battery Applications

    Naga Venkateswara Rao Nulakani, Yarjan Abdul Samad, Ameen Shahid +2

    PreprintGraphene research and applicationsSSRN Electronic Journal20250 citations
    ABI

  11. A Comparative DFT Study of the Adsorption of SF6 Decomposition Gas Species (SO2, SO2F2, and SOF4) on Si- and Al-Modified MoSTe Nanosheets: Application to Gas Sensors

    Qamar Abuhassan, Ahmed Aldulaimi, Omayma Salim Waleed +8

    Article2D Materials and ApplicationsJournal of Electronic Materials20260 citations
    ABI

  12. Evaluation of graphene like SiC2 as an electrode material for Ca-ion batteries: A DFT study

    Ali B.M. Ali, Narinderjit Singh Sawaran Singh, Subbulakshmi Ganesan +8

    ArticleAdvancements in Battery MaterialsSilicon20260 citations
    ABI

  13. Tuning the electronic and optical properties of ZnO through sulfur doping: A DFT study

    G.B. Eshonqulov, D.G. Berdiyorova, D.K. Shodieva +2

    ArticleZnO doping and propertiesSolid State Communications20260 citations
    ABI

  14. Efficient storage and separation of methane using the metal–organic frameworks M2(m-dobdc)(M = Fe, Co, Ni, and Cu): a first-principles study

    Ali M. Hussein, Narinderjit Singh Sawaran Singh, Muktha Eti +8

    ArticleMetal-Organic Frameworks: Synthesis and ApplicationsTransition Metal Chemistry20260 citations
    ABI

  15. Adsorption of N containing gas molecules on the noble metal (Ir, Os and Pt) modified silicene nanosheets: a theoretical study using DFT and electron density simulations

    Qamar Abuhassan, Ahmed Aldulaimi, Omayma Salim Waleed +8

    ArticleGraphene research and applicationsApplied Physics A20260 citations
    ABI

  16. Lithium-decorated porous BC <sub>2</sub> P monolayer: a novel high-capacity material for efficient and reversible hydrogen molecule storage

    Qamar Abuhassan, Luma Hussain Saleh, G. PadmaPriya +8

    ArticleBoron and Carbon Nanomaterials ResearchNew Journal of Chemistry20260 citations
    ABI

  17. Metal-decorated carbon-doped BN fullerenes as highly efficient materials for solid-state hydrogen storage: insights from DFT calculations

    Qamar Abuhassan, Luma Hussain Saleh, G. PadmaPriya +8

    ArticleBoron and Carbon Nanomaterials ResearchNew Journal of Chemistry20260 citations
    ABI