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73 ta ish

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

  1. Multiwfn: A multifunctional wavefunction analyzer

    Tian Lu, Feiwu Chen

    Maqola2011110 iqtibos
    ABI

  2. cclib: A library for package‐independent computational chemistry algorithms

    Noel M. O’Boyle, Adam L. Tenderholt, Karol M. Langner

    Maqola200727 iqtibos
    ABI

  3. Graphene: Status and Prospects

    A. K. Geǐm

    Maqola200915 iqtibos
    ABI

  4. Sarlavhasiz

    Boshqa12 iqtibos
    ABI

  5. 6‐31G* basis set for third‐row atoms

    Vitaly A. Rassolov, Mark A. Ratner, John A. Pople +2

    Maqola20019 iqtibos
    ABI

  6. Polarizable continuum model

    Benedetta Mennucci

    Maqola20129 iqtibos
    ABI

  7. Quantum Theory of Atoms in Molecules–Dalton Revisited

    R. F. W. Bader, T. T. Nguyen‐Dang

    Bob19818 iqtibos
    ABI

  8. A possible definition of basis set superposition error

    Ernest R. Davidson, Subhas J. Chakravorty

    Maqola19948 iqtibos
    ABI

  9. Sarlavhasiz

    Boshqa7 iqtibos
    ABI

  10. Sensing the formaldehyde pollutant by an enhanced BNC18 fullerene: DFT outlook

    Miao Dai, M. Mirzaei, Farzad Toiserkani +4

    Maqola20235 iqtibos
    ABI

  11. Recent advances on graphene: Synthesis, properties and applications

    Feizhi Zhang, Kang Yang, Guanjun Liu +4

    Maqola20225 iqtibos
    ABI

  12. Study on novel fluorescent carbon nanomaterials in food analysis

    Ngafwan NGAFWAN, Harun Al Rasyid, Emad Salaam Abood +4

    Maqola20215 iqtibos
    ABI

  13. A facile detection of ethanol by the Be/Mg/Ca-enhanced fullerenes: Insights from density functional theory

    Farzad Toiserkani, M. Mirzaei, Veysel Alcan +2

    Maqola20234 iqtibos
    ABI

  14. In silico xanthine oxidase inhibitory activities of alkaloids isolated from Alphonsea sp.

    M. Nur Sidik, Yuhanis Mhd Bakri, Saripah Salbiah Syed Abdul Azziz +3

    Maqola20224 iqtibos
    ABI

  15. 2D Material Chemistry: Graphdiyne-based Biochemical Sensing

    Jiaofu Li, Changjin Wan, Cong Wang +2

    Maqola20204 iqtibos
    ABI

  16. A novel and efficient magnetically recoverable copper catalyst [MNPs-guanidine-bis(ethanol)-Cu] for Pd-free Sonogashira coupling reaction

    Indrajit Patra, Faris H. Mohammed, Ahmed Kareem Obaid Aldulaimi +2

    Maqola20223 iqtibos
    ABI

  17. The role of NaOH and papaya latex bio-activator during production of carbon nanoparticle from rice husks

    N Ngafwan, I.N.G. Wardana, Widya Wijayanti +1

    Maqola20183 iqtibos
    ABI

  18. Types of Nanostructures

    Mahmoud Nasrollahzadeh, Zahra Issaabadi, Mohaddeseh Sajjadi +2

    Bob20193 iqtibos
    ABI

  19. The Development Trend of Graphene Derivatives

    Chen Li, Cun Zheng, Feng Cao +2

    Maqola20223 iqtibos
    ABI

  20. Boron nitride nanotube (BNNT) as a sensor of hydroperoxyl radical (HO2): A DFT study

    Mohammad Solimannejad, Motahareh Noormohammadbeigi

    Maqola20163 iqtibos
    ABI

  21. Adsorption of H<sub>2</sub>S at Stone–Wales defects of graphene-like BC<sub>3</sub>: a computational study

    Ali Ahmadi Peyghan, Hamed Soleymanabadi

    Maqola20143 iqtibos
    ABI

  22. Graphdiyne: synthesis, properties, and applications

    Xin Gao, Huibiao Liu, Dan Wang +1

    Sharh maqola20192 iqtibos
    ABI

  23. Utilization of Gas Sensor Array and Principal Component Analysis to Identify Fish Decomposition Level

    Budi Sumanto, Muhammad Fakhrurrifqi

    Maqola20202 iqtibos
    ABI

  24. Sarlavhasiz

    Boshqa2 iqtibos
    ABI

  25. Molecular interactions of indomethacin and amino acids: Computational approach

    Ali Parkan, Mahmoud Mirzaei, Naser Tavakoli +1

    Maqola20212 iqtibos
    ABI