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Published in 2017 at "Journal of Molecular Modeling"
DOI: 10.1007/s00894-017-3299-7
Abstract: AbstractUsing armchair-type single-walled carbon nanotubes (SWCNTs) of different sizes as model compounds for lignite, the effect of water molecule confinement on the water-holding capacity of lignite pores was investigated. Results indicated that the water-holding capacity…
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Keywords:
configuration;
water;
carbon nanotubes;
water molecules ... See more keywords