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Autor:
Kenneth M. Benjamin, Samuel Gunderson, Alireza Asiaee, Casey Losinski, Carrie Veer, Trevor Larson
Publikováno v:
The Journal of Physical Chemistry C. 120:21336-21343
Monte Carlo (MC) simulations were used to determine the near- and supercritical fluid phase behavior of hexane and the adsorption thermodynamics of hexane on cobalt. Canonical ensemble MC simulations were used to compute the equation of state and che