Supramolecular nanoporous carbon materials based on the arrays of carbon nanotubes, ordered by cyclic hydrocarbons for methane and hydrogen storageстатья
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Дата последнего поиска статьи во внешних источниках: 20 мая 2019 г.
Аннотация:In this work a possibility of formation of supramolecular structures based on carbon nanotubes and coordinate molecules – cyclic
hydrocarbons (including aromatic) was studied by means of molecular dynamics method. Model supramolecular structures were
defined as arrays of nanotubes, coordinated by hydrocarbon molecules mainly in triangular package. A correlation between the
sizes of coordinate molecules and average distances between nanotubes in the structures was defined as well as conditions of
porosity development between the nanotubes while maintaining their ordered arrangement. Maximal adsorption of methane and
hydrogen in model structures was estimated in space between the nanotubes as well as inside them.