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8 ta ish

Ish: A possible definition of basis set superposition error

  1. The drug delivery of methimazole through the sensing function assessments of BeO fullerene-like particles: DFT study

    Mounir M. Salem‐Bekhit, Miao Dai, Mavjuda Rakhmatullaeva +3

    MaqolaGraphene research and applicationsChemical Physics Impact20235 iqtibos
    ABI

  2. Assessing BeO, MgO, and CaO nanocages for a facile detection of hazardous phosgene oxime along with DFT calculations

    Mohamed J. Saadh, M. Mirzaei, Sherzod Abdullaev +4

    MaqolaThermal and Kinetic AnalysisColloids and Surfaces A Physicochemical and Engineering Aspects20233 iqtibos
    ABI

  3. Density functional theory assessments of an iron-doped graphene platform towards the hydrea anticancer drug delivery

    Mohamed J. Saadh, M. Mirzaei, Shahad Mohammed Dhiaa +4

    MaqolaGraphene and Nanomaterials ApplicationsDiamond and Related Materials20232 iqtibos
    ABI

  4. An enhanced adsorption of paracetamol drug using the iron-encapsulated boron carbide nanocage: DFT outlook

    Mohamed J. Saadh, Mustafa Nasrat Abdulraheem, Hanan Hassan Ahmed +7

    MaqolaBoron and Carbon Nanomaterials ResearchComputational and Theoretical Chemistry20230 iqtibos
    ABI

  5. Assessments of carbon and boron nitride graphdiyne nanosheets for exploring the amphetamine drug adsorbents/sensors along with density functional theory

    Mohamed J. Saadh, Sura Mohammad Mohealdeen, Chou‐Yi Hsu +5

    MaqolaGraphene research and applicationsChemical Physics Impact20230 iqtibos
    ABI

  6. Density functional theory based analyses of beryllium oxide fullerene assisted adsorptions of ammonia, phosphine, and arsine toxic gases towards sensing and removal prospective applications

    Chou‐Yi Hsu, Mohamed J. Saadh, ‎Anmar Ghanim Taki +10

    MaqolaGraphene research and applicationsColloids and Surfaces A Physicochemical and Engineering Aspects20240 iqtibos
    ABI

  7. Structural and electronic assessments of Thiamazole adsorption on the transition metal doped fullerenes as a potential smart drug delivery platform

    Mohamed J. Saadh, Ahmad I. Ayesh, M. El‐Muraikhi +8

    MaqolaFullerene Chemistry and ApplicationsPhysica B Condensed Matter20240 iqtibos
    ABI

  8. A molecular insight into the development of sensitive glucometers along with DFT investigation of glucose adsorption by a beryllium oxide particle

    Mohamed J. Saadh, Tamara shamil addulrahman, J. Narayanan +10

    MaqolaElectrochemical sensors and biosensorsPhysica B Condensed Matter20240 iqtibos
    ABI