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47 ta ish

Ish: 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

    Maqola198439 iqtibos
    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

    Maqola202138 iqtibos
    ABI

  3. Canonical sampling through velocity rescaling

    Giovanni Bussi, Davide Donadio, Michele Parrinello

    Maqola200726 iqtibos
    ABI

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

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

    Maqola200310 iqtibos
    ABI

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

    Meiling Yue, Hugo Lambert, Elodie Pahon +3

    Sharh maqola20219 iqtibos
    ABI

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

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

    Maqola20086 iqtibos
    ABI

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

    Umedjon Khalilov, Utkir Uljayev, Kamoliddin Mehmonov +3

    MaqolaHydrogen Storage and MaterialsInternational Journal of Hydrogen Energy20235 iqtibos
    ABI

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

    N.A.A. Rusman, Mahidzal Dahari

    Sharh maqola20164 iqtibos
    ABI

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

    Ju Li, Terumi Furuta, Hajime Goto +3

    Maqola20033 iqtibos
    ABI

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

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

    Maqola20023 iqtibos
    ABI

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

    Gerasimos E. Ioannatos, Xenophon E. Verykios

    Maqola20093 iqtibos
    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

    Maqola20023 iqtibos
    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

    Maqola20103 iqtibos
    ABI

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

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

    Maqola20163 iqtibos
    ABI

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