Phases of neon, xenon, and methane adsorbed on nanotube bundles

M. M. Calbi, S. M. Gatica, M. J. Bojan, Milton Walter Cole

Research output: Contribution to journalArticle

88 Citations (Scopus)

Abstract

The sequential appearance of phases on the outer surface of a bundle of nanotubes was explored. Ground state calculations for the Ne and CH4 found the 1D groove phase to be followed by the 3-stripe phase. The zigzag phase was not stable relative to either of these any 1D density. No evidence was found of a zigzag phase for Ne, Ar, Kr, or Xe in any of the simulation.

Original languageEnglish (US)
Pages (from-to)9975-9981
Number of pages7
JournalJournal of Chemical Physics
Volume115
Issue number21
DOIs
StatePublished - Dec 1 2001

Fingerprint

Neon
Xenon
Methane
neon
grooves
xenon
Nanotubes
Ground state
bundles
nanotubes
methane
ground state
simulation

All Science Journal Classification (ASJC) codes

  • Atomic and Molecular Physics, and Optics

Cite this

Calbi, M. M., Gatica, S. M., Bojan, M. J., & Cole, M. W. (2001). Phases of neon, xenon, and methane adsorbed on nanotube bundles. Journal of Chemical Physics, 115(21), 9975-9981. https://doi.org/10.1063/1.1414376
Calbi, M. M. ; Gatica, S. M. ; Bojan, M. J. ; Cole, Milton Walter. / Phases of neon, xenon, and methane adsorbed on nanotube bundles. In: Journal of Chemical Physics. 2001 ; Vol. 115, No. 21. pp. 9975-9981.
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Calbi, MM, Gatica, SM, Bojan, MJ & Cole, MW 2001, 'Phases of neon, xenon, and methane adsorbed on nanotube bundles', Journal of Chemical Physics, vol. 115, no. 21, pp. 9975-9981. https://doi.org/10.1063/1.1414376

Phases of neon, xenon, and methane adsorbed on nanotube bundles. / Calbi, M. M.; Gatica, S. M.; Bojan, M. J.; Cole, Milton Walter.

In: Journal of Chemical Physics, Vol. 115, No. 21, 01.12.2001, p. 9975-9981.

Research output: Contribution to journalArticle

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