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Иш: Molecular dynamics study of ethanol solvated by water on the Pt (111) surface

  1. Computational Chemistry: A Practical Guide for Applying Techniques to Real World Problems

    David C. Young

    Китоб200110 иқтибос
    ABI

  2. CHARMM: The biomolecular simulation program

    Bernard R. Brooks, Charles L. Brooks, Alexander D. MacKerell +32

    Шарҳ мақола20095 иқтибос
    ABI

  3. Implementation of the CHARMM Force Field in GROMACS: Analysis of Protein Stability Effects from Correction Maps, Virtual Interaction Sites, and Water Models

    Pär Bjelkmar, Per Larsson, Michel A. Cuendet +2

    Мақола20104 иқтибос
    ABI

  4. DL_POLY_2.0: A general-purpose parallel molecular dynamics simulation package

    William R. Smith, Timothy R. Forester

    Мақола19964 иқтибос
    ABI

  5. Catalytic site requirements for elementary steps in syngas conversion to oxygenates over promoted rhodium

    Wolfgang M.H. Sachtler, Masaru Ichikawa

    Мақола19864 иқтибос
    ABI

  6. General Model for Water Monomer Adsorption on Close-Packed Transition and Noble Metal Surfaces

    Angelos Michaelides, Víctor A. Ranea, P. L. de Andrés +1

    Мақола20033 иқтибос
    ABI

  7. Molecular dynamics simulation of ethanol/water mixtures for structure and diffusion properties

    Cuijuan Zhang, Xiaoning Yang

    Мақола20053 иқтибос
    ABI

  8. Adsorption Mechanism and Dynamic Behavior of Water and Ethanol Molecules inside Au Nanotubes

    Yaochun Wang, Chuan Chen, Shin‐Pon Ju

    Мақола20083 иқтибос
    ABI

  9. Molecular dynamics simulation of self‐diffusion coefficient and its relation with temperature using simple Lennard‐Jones potential

    Weizhong Li, Cong Chen, Yang Jian

    Мақола20083 иқтибос
    ABI

  10. Long-range Finnis–Sinclair potentials

    Adrian P. Sutton, Jinlin Chen

    Мақола19903 иқтибос
    ABI

  11. High permeability membranes for the dehydration of low water content ethanol by pervaporation

    Vasudevan V. Namboodiri, Leland M. Vane

    Мақола20073 иқтибос
    ABI

  12. Recent progress in direct ethanol proton exchange membrane fuel cells (DE-PEMFCs)

    Shuqin Song, Panagiotis Tsiakaras

    Мақола20052 иқтибос
    ABI

  13. Direct ethanol PEM fuel cells: The case of platinum based anodes

    Seung‐Wan Song, Wu Zhou, Zhi‐You Zhou +6

    Мақола20052 иқтибос
    ABI

  14. Solution Dynamics in Aqueous Monohydric Alcohol Systems

    William S. Price, Hiroyuki Ide, Yoji Arata

    Мақола20032 иқтибос
    ABI

  15. Hydration of methanol in aqueous solution

    Alan K. Soper, John Finney

    Мақола19932 иқтибос
    ABI

  16. Interaction of Ethanol and Water with the {1014} Surface of Calcite

    David J. Cooke, Richard J. Gray, Karina K. Sand +2

    Мақола20102 иқтибос
    ABI

  17. Dynamic properties of water/alcohol mixtures studied by computer simulation

    Erik J. W. Wensink, Alex C. Hoffmann, Paul J. van Maaren +1

    Мақола20032 иқтибос
    ABI

  18. Carbon supported PtRh catalysts for ethanol oxidation in alkaline direct ethanol fuel cell

    Shuiyun Shen, Tianshou Zhao, Jianbo Xu

    Мақола20102 иқтибос
    ABI

  19. MD simulation of cluster–surface impacts for metallic phases: soft landing, droplet spreading and implantation

    Kholmirzo Kholmurodov, И.В. Пузынин, William R. Smith +2

    Мақола20012 иқтибос
    ABI

  20. Trends in biotechnological production of fuel ethanol from different feedstocks

    Óscar J. Sánchez, Carlos Ariel Cardona Álzate

    Шарҳ мақола20082 иқтибос
    ABI

  21. Equilibrium liquidus temperatures of binary mixtures from differential scanning calorimetry

    T. Kousksou, A. Jamil, Y. Zéraouli +1

    Мақола20072 иқтибос
    ABI

  22. Fuel ethanol production: Process design trends and integration opportunities

    Carlos Ariel Cardona Álzate, Óscar J. Sánchez

    Шарҳ мақола20072 иқтибос
    ABI

  23. Computer Simulation Study of <i>tert</i>-Butyl Alcohol. 2. Structure in Aqueous Solution

    Peter G. Kusalik, Alexander P. Lyubartsev, Dan L. Bergman +1

    Мақола20002 иқтибос
    ABI

  24. Electrodeposited Metals at Conducting Polymer Electrodes. II: Study of the Oxidation of Methanol at Poly(3-methylthiophene) Modified with Pt–Pd Co-catalyst

    Ahmed Galal, Nada F. Atta, Soher A. Darwish +1

    Мақола20082 иқтибос
    ABI

  25. Estimation of surface diffusion coefficient in liquid phase adsorption

    Kanji Miyabe, Shigeya Takeuchi

    Мақола19982 иқтибос
    ABI