Upper storage-capacity limit and multiple occupancy phenomena in H2-hydroquinone clathrates using Monte Carlo and DFT simulations

  1. Parage, B.
  2. Miqueu, C.
  3. Pérez-Rodríguez, M.
  4. Méndez-Morales, T.
  5. Piñeiro, M.M.
Journal:
Physical Chemistry Chemical Physics

ISSN: 1463-9076

Year of publication: 2024

Volume: 26

Issue: 8

Pages: 6939-6948

Type: Article

DOI: 10.1039/D3CP05331H GOOGLE SCHOLAR lock_openOpen access editor