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32 works

Work: LAMMPS - a flexible simulation tool for particle-based materials modeling at the atomic, meso, and continuum scales

  1. Can endohedral transition metals enhance hydrogen storage in carbon nanotubes?

    Umedjon Khalilov, Utkir Uljayev, Kamoliddin Mehmonov +3

    ArticleHydrogen Storage and MaterialsInternational Journal of Hydrogen Energy20234 citations
    ABI

  2. Dual-functional Quercus palustris leaves extract as a sustainable corrosion inhibitor for low-carbon steel and its biomedical potential: Electrochemical, biological, and computational insights

    Rajesh Haldhar, Chaitany Jayprakash Raorane, Vishwajeet Bachhar +4

    ArticleCorrosion Behavior and InhibitionSustainable materials and technologies20254 citations
    ABI

  3. Synthesis investigation and exploring of new tetraglycidyl bisurea bisphenyl S polyepoxide as an excellent corrosion inhibitory resin for mild steel in 1M HCl environment: Comprehensive approaches

    Mouna Azogagh, Anouar El Magri, Rachid Hsissou +6

    ArticleCorrosion Behavior and InhibitionJournal of Molecular Liquids20244 citations
    ABI

  4. Synthesis and characterization of diglycidyl bisphenol A aryl ether sulfone epoxy resin as a corrosion inhibitor for mild steel in 1 M HCl solution: DFT, MC, and MD studies

    Mouna Azogagh, Chaymae Hejjaj, Rachid Hsissou +8

    ArticleCorrosion Behavior and InhibitionPolymer Bulletin20254 citations
    ABI

  5. The role of carbon monoxide in the catalytic synthesis of endohedral carbyne

    Kamoliddin Mehmonov, Aziza Ergasheva, Maksudbek Yusupov +1

    ArticleFullerene Chemistry and ApplicationsJournal of Applied Physics20233 citations
    ABI

  6. Structural and thermal analyses in semiconducting and metallic zigzag single-walled carbon nanotubes using molecular dynamics simulations

    Ama tul Zahra, Aamir Shahzad, Alina Manzoor +4

    ArticleCarbon Nanotubes in CompositesPLoS ONE20243 citations
    ABI

  7. Rheological and anticorrosion study of Piper chaba extract and coating for mild steel in 2M H2SO4

    Vibha Joshi, Vishwajeet Bachhar, Prayas Singh +5

    ArticleCorrosion Behavior and InhibitionColloids and Surfaces A Physicochemical and Engineering Aspects20242 citations
    ABI

  8. Formation Onset of Flat-Perylene Prenucleation Clusters in Vacuum

    Dilfuza Husanova, Jurat Ochilov, Umedjon Khalilov

    ArticleCrystallography and molecular interactionsChemical Physics20242 citations
    ABI

  9. The novel inhibitive action of the N-(p-ethylphenyl)thiobenzohydroxamic acid for mild steel in 1 M HCl medium: electrochemical, thermodynamic, DFT, and MD simulation study

    Yeestdev Dewangan, Bhaskaran Bhaskaran, Vivek Kumar Mishra +7

    ArticleCorrosion Behavior and InhibitionThe European Physical Journal Plus20252 citations
    ABI

  10. Nitrogen Adsorption on Double-Walled Carbon Nanotube at Different Temperatures: Mechanistic Insights from Molecular Dynamics Simulations

    Utkir B. Uljaev, Shakhnozaxon A. Muminova, I.D. Yadgarov

    ArticleCarbon Nanotubes in CompositesEast European Journal of Physics20242 citations
    ABI

  11. A sustainable triple-action inhibitor: Corrosion protection, antioxidant activity, and antibacterial performance of Solanum chrysotrichum fruit extract

    Vishwajeet Bachhar, Vibha Joshi, Rajesh Haldhar +4

    ArticleEssential Oils and Antimicrobial ActivityBioresource Technology20251 citations
    ABI

  12. Performance of advanced composites as some corrosion protection coatings for 3D-printed H13 steel in 1M HCl: Elaboration, experimental and theoretical studies

    Rachid Hsissou, Ilham Aichouch, Anouar El Magri +5

    ArticleAdvanced ceramic materials synthesisColloids and Surfaces A Physicochemical and Engineering Aspects20251 citations
    ABI

  13. Enhanced hydrogen retention in Ni-filled carbon nanotubes at high temperatures

    Utkir Uljayev, Farkhodjon Turaev, Abror Ulukmuradov +2

    ArticleHydrogen Storage and MaterialsChemical Physics Letters20251 citations
    ABI

  14. Driving catalytic carbyne formation within endohedral DWCNTs: the role of Ni <i>vs.</i> Pt

    Kamoliddin Mehmonov, Aziza Ergasheva, S. Mehdi Vaez Allaei +2

    ArticleDiamond and Carbon-based Materials ResearchNanoscale20251 citations
    ABI

  15. Suntulip: New Tool to Simulate Solar Cells

    Jasurbek Gulomov, Oussama Accouche, Bilel Neji +1

    Articlesolar cell performance optimizationIEEE Access20230 citations
    ABI

  16. THE INFLUENCE OF NITROGEN ATOMS ON CARBON NANOTUBES AT DIFFERENT TEMPERATURES

    Sh.A Muminova, I.D. Yadgarov, O‘.B. O‘ljayev

    ArticleBoron and Carbon Nanomaterials Research20230 citations
    ABI

  17. THE EFFECT OF OXYGEN IN THE CATALYTIC SYNTHESIS OF ENDOHEDRAL CARBYNE

    Kamoliddin Mehmonov

    ArticleFullerene Chemistry and Applications20230 citations
    ABI

  18. Integrating high-performance computing, machine learning, data management workflows, and infrastructures for multiscale simulations and nanomaterials technologies

    Fabio Le Piane, Mario Vozza, Matteo Baldoni +1

    ArticleMachine Learning in Materials ScienceBeilstein Journal of Nanotechnology20240 citations
    ABI

  19. Boron interaction with double-walled carbon nanotubes across temperature ranges

    Utkir Uljayev, S.R. Muminova, Kamoliddin Mehmonov +2

    ArticleCarbon Nanotubes in CompositesModern Electronic Materials20240 citations
    ABI

  20. Gravimetric, electrochemical, surface morphological, and simulation studies of the use of expired Meftal-P drug as a novel anti-corrosive coating material for steel in 0.5 M HCl

    Akhil Saxena, Jasdeep Kaur, Vishal Mutreja +5

    ArticleCorrosion Behavior and InhibitionThe European Physical Journal Plus20250 citations
    ABI

  21. Phytochemical-based corrosion inhibitor: <i>Hibiscus sabdariffa</i> leaf extract for steel in acidic environments

    G. J. Okore, P. I. Okeke, C. O. Akalezi +6

    ArticleHibiscus Plant Research StudiesCanadian Metallurgical Quarterly20250 citations
    ABI

  22. Atomic-Scale Mechanisms Controlling the Early Aggregation of Sub 10 nm Amorphous Silica Nanoparticles in Vacuum

    Dilfuza Husanova, Kamoladdin Egamberdiev, Fakhriddin Safarov +4

    ArticlePhotonic Crystals and ApplicationsThe Journal of Physical Chemistry C20250 citations
    ABI

  23. Exploration of the Ocimum americanum extract as a novel pickling agent for steel in sulfuric acid medium: electrochemical, surface modification, DFT, and MC simulation studies

    Sharma Abhishek, Akhil Saxena, Jasdeep Kaur +6

    ArticleCorrosion Behavior and InhibitionThe European Physical Journal Plus20250 citations
    ABI

  24. Plasma-assisted catalysis for graphene pre-nucleation: the role of high-index nickel nanocrystal surfaces

    Tursunpulat Juraboev, Feruz Khaydarov, Quan‐Zhi Zhang +2

    ArticleGraphene research and applicationsChemical Physics Letters20250 citations
    ABI

  25. Effects of thermal shock on the performance of welded metallic compounds: A molecular dynamics approach

    E. Wang, Ali Basem, Zahraa Abed Hussein +5

    ArticleMicrostructure and mechanical propertiesInternational Communications in Heat and Mass Transfer20250 citations
    ABI