Joanna Grabowska - Publications - Bridge of Knowledge

Search

Filters

total: 12

  • Category
  • Year
  • Options

clear Chosen catalog filters disabled

Catalog Publications

Year 2024
Year 2023
  • Homogeneous nucleation rate of methane hydrate formation under experimental conditions from seeding simulations
    Publication
    • J. Grabowska
    • S. Blazquez
    • E. Sanz
    • E. G. Noya
    • I. M. Zerón
    • J. Algaba
    • J. M. Míguez
    • F. J. Blas
    • C. Vega

    - JOURNAL OF CHEMICAL PHYSICS - Year 2023

    In this work, we shall estimate via computer simulations the homogeneous nucleation rate for the methane hydrate at 400 bars for a supercooling of about 35 K. The TIP4P/ICE model and a Lennard-Jones center were used for water and methane, respectively. To estimate the nucleation rate, the seeding technique was employed. Clusters of the methane hydrate of different sizes were inserted into the aqueous phase of a two-phase gas–liquid...

    Full text available to download

  • Solubility of carbon dioxide in water: Some useful results for hydrate nucleation
    Publication
    • J. Algaba
    • I. M. Zerón
    • J. M. Míguez
    • J. Grabowska
    • S. Blazquez
    • E. Sanz
    • C. Vega
    • F. J. Blas

    - JOURNAL OF CHEMICAL PHYSICS - Year 2023

    In this paper, the solubility of carbon dioxide (CO2) in water along the isobar of 400 bar is determined by computer simulations using the well-known TIP4P/Ice force field for water and the TraPPE model for CO2. In particular, the solubility of CO2 in water when in contact with the CO2 liquid phase and the solubility of CO2 in water when in contact with the hydrate have been determined. The solubility of CO2 in a liquid–liquid...

    Full text available to download

Year 2022
  • Solubility of Methane in Water: Some Useful Results for Hydrate Nucleation
    Publication
    • J. Grabowska
    • S. Blazquez
    • E. Sanz
    • I. M. Zerón
    • J. Algaba
    • J. M. Míguez
    • F. J. Blas
    • C. Vega

    - JOURNAL OF PHYSICAL CHEMISTRY B - Year 2022

    In this paper, the solubility of methane in water along the 400 bar isobar is determined by computer simulations using the TIP4P/Ice force field for water and a simple LJ model for methane. In particular, the solubility of methane in water when in contact with the gas phase and the solubility of methane in water when in contact with the hydrate has been determined. The solubility of methane in a gas–liquid system decreases as temperature...

    Full text available to download

Year 2021
Year 2020
Year 2019
Year 2018
Year 2017
Year 2016

seen 1574 times