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Иш: Metal-dependent hydrogen physisorption in (5,5) carbon nanotubes: Comparative insights into Pt and Ni effects

  1. Molecular dynamics with coupling to an external bath

    Herman J. C. Berendsen, Johan P. M. Postma, Wilfred F. van Gunsteren +2

    Мақола198439 иқтибос
    ABI

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

    Aidan P. Thompson, Hasan Metin Aktulga, Richard Berger +12

    Мақола202138 иқтибос
    ABI

  3. Canonical sampling through velocity rescaling

    Giovanni Bussi, Davide Donadio, Michele Parrinello

    Мақола200726 иқтибос
    ABI

  4. Chemically Doped Double-Walled Carbon Nanotubes: Cylindrical Molecular Capacitors

    Gugang Chen, Shunji Bandow, Elena R. Margine +7

    Мақола200310 иқтибос
    ABI

  5. Hydrogen energy systems: A critical review of technologies, applications, trends and challenges

    Meiling Yue, Hugo Lambert, Elodie Pahon +3

    Шарҳ мақола20219 иқтибос
    ABI

  6. ReaxFF Reactive Force Field for Molecular Dynamics Simulations of Hydrocarbon Oxidation

    Kimberly Chenoweth, Adri C. T. van Duin, William A. Goddard

    Мақола20086 иқтибос
    ABI

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

    Umedjon Khalilov, Utkir Uljayev, Kamoliddin Mehmonov +3

    МақолаHydrogen Storage and MaterialsInternational Journal of Hydrogen Energy20235 иқтибос
    ABI

  8. A review on the current progress of metal hydrides material for solid-state hydrogen storage applications

    N.A.A. Rusman, Mahidzal Dahari

    Шарҳ мақола20164 иқтибос
    ABI

  9. Theoretical evaluation of hydrogen storage capacity in pure carbon nanostructures

    Ju Li, Terumi Furuta, Hajime Goto +3

    Мақола20033 иқтибос
    ABI

  10. Hydrogen desorption properties of multiwall carbon nanotubes with closed and open structures

    Ho Lee, Youn-Seon Kang, Seoung-Hoe Kim +1

    Мақола20023 иқтибос
    ABI

  11. H2 storage on single- and multi-walled carbon nanotubes

    Gerasimos E. Ioannatos, Xenophon E. Verykios

    Мақола20093 иқтибос
    ABI

  12. Interaction of molecular and atomic hydrogen with (5,5) and (6,6) single-wall carbon nanotubes

    J.S. Arellano, L. M. Molina, Ángel Rubio +2

    Мақола20023 иқтибос
    ABI

  13. Development and Validation of ReaxFF Reactive Force Field for Hydrocarbon Chemistry Catalyzed by Nickel

    Jonathan E. Mueller, Adri C. T. van Duin, William A. Goddard

    Мақола20103 иқтибос
    ABI

  14. Adsorption of Hydrogen Molecules on Carbon Nanotubes Using Quantum Chemistry and Molecular Dynamics

    Noelia Faginas‐Lago, D. Yeni, F. Huarte +3

    Мақола20163 иқтибос
    ABI

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