Molecular simulation of co2 and h2 encapsulation in a nanoscale porous liquid

HIGHLIGHTS

• who: Pablo Collado et al. from the Departamento de Fu00edsica Aplicada, Universidade de Vigo, Vigo, Spain have published the article: Molecular Simulation of CO2 and H2 Encapsulation in a Nanoscale Porous Liquid, in the Journal: Nanomaterials 2023, 13, 409. of /2023/
• what: The theoretical approach used in this work shows remarkable ability, as will be demonstrated in the following, to capture the physico-chemical subtleties of this PL selective adsorption process. If the authors compare the number of occupations of H2 and CO2 during the simulation, the authors can observe that H2 tends to dominate . . .
  

   

  

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