Cited Article: Holt JK. Fast mass transport through sub-2-nanometer carbon nanotubes
Alert Expires: 18 OCT 2009
Number of Citing Articles: 2 new records this week (2 in this e-mail)
Organization ID: 3b97d1bbc1878baed0ab183d8b03130b
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*Record 1 of 2.
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AU Kofinger, J
Dellago, C
AF Koefinger, Juergen
Dellago, Christoph
TI Orientational Dynamics and Dielectric Response of Nanopore Water
SO PHYSICAL REVIEW LETTERS
LA English
DT Article
ID BORON-NITRIDE NANOTUBE; CARBON NANOTUBES; CONDUCTION; TRANSPORT; PORES
AB We present numerical calculations, simulation results, and analytical
considerations for the frequency-dependent dielectric constant of
single-file water in narrow nanopores, described by a recently
developed dipole lattice model. We find Debye relaxation over all
length scales with relaxation times that strongly depend on pore
length. This behavior is analyzed in terms of the dynamics of
orientational defects leading to simple quantitative expressions for
the static dielectric susceptibility and the relaxation time in the
limits of short and long pores. Based on these formulas, we suggest how
the predicted macroscopic order of nanopore water can be probed via
dielectric spectroscopy and explain how the excitation energy,
diffusion constant, and effective interaction of the defects that
destroy the order can be extracted from such measurements.
C1 [Koefinger, Juergen] Univ Vienna, Fac Phys, A-1090 Vienna, Austria.
Univ Vienna, Ctr Computat Mat Sci, A-1090 Vienna, Austria.
RP Kofinger, J, Univ Vienna, Fac Phys, Boltzmanngasse 5, A-1090 Vienna,
Austria.
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NR 28
TC 0
PU AMER PHYSICAL SOC; ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA
SN 0031-9007
DI 10.1103/PhysRevLett.103.080601
PD AUG 21
VL 103
IS 8
AR 080601
SC Physics, Multidisciplinary
GA 487PY
UT ISI:000269288500009
ER
PT J
*Record 2 of 2.
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*Order Full Text [ ]
AU Du, AJ
Sun, CH
Zhu, ZH
Lu, GQ
Rudolph, V
Smith, SC
AF Du, A. J.
Sun, C. H.
Zhu, Z. H.
Lu, G. Q.
Rudolph, V.
Smith, Sean C.
TI The effect of Fe doping on adsorption of CO2/N-2 within carbon
nanotubes: a density functional theory study with dispersion corrections
SO NANOTECHNOLOGY
LA English
DT Article
ID MEMBRANES; FLUX
AB An ab initio density functional theory (DFT) study with correction for
dispersive interactions was performed to study the adsorption of N-2
and CO2 inside an (8, 8) single-walled carbon nanotube. We find that
the approach of combining DFT and van der Waals correction is very
effective for describing the long-range interaction between N-2/CO2 and
the carbon nanotube (CNT). Surprisingly, exohedral doping of an Fe atom
onto the CNT surface will only affect the adsorption energy of the
quadrupolar CO2 molecule inside the CNT (20-30%), and not that of
molecular N-2. Our results suggest the feasibility of enhancement of
CO2/N-2 separation in CNT-based membranes by using exohedral doping of
metal atoms.
C1 [Du, A. J.; Sun, C. H.; Smith, Sean C.] Univ Queensland, AIBN, Ctr Computat Mol Sci, Brisbane, Qld 4072, Australia.
[Du, A. J.; Sun, C. H.; Lu, G. Q.; Smith, Sean C.] Univ Queensland, AIBN, ARC Ctr Funct Nanomat, Brisbane, Qld 4072, Australia.
[Zhu, Z. H.; Rudolph, V.] Univ Queensland, Sch Engn, Div Chem Engn, Brisbane, Qld 4072, Australia.
RP Du, AJ, Univ Queensland, AIBN, Ctr Computat Mol Sci, Bldg 75, Brisbane,
Qld 4072, Australia.
EM a.du@uq.edu.au
z.zhu@uq.edu.au
s.smith@uq.edu.au
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10.1016/j.memsci.2005.06.030
DU AJ, 2005, NANOTECHNOLOGY, V16, P2118, DOI 10.1088/0957-4484/16/10/024
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FREEMAN BD, 1999, MACROMOLECULES, V32, P375
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HOLT JK, 2006, SCIENCE, V312, P1034, DOI 10.1126/science.1126298
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ZHU ZH, 2004, CARBON, V42, P2509, DOI 10.1016/j.carbon.2004.05.019
NR 22
TC 0
PU IOP PUBLISHING LTD; DIRAC HOUSE, TEMPLE BACK, BRISTOL BS1 6BE, ENGLAND
SN 0957-4484
DI 10.1088/0957-4484/20/37/375701
PD SEP 16
VL 20
IS 37
AR 375701
SC Engineering, Multidisciplinary; Nanoscience & Nanotechnology; Materials
Science, Multidisciplinary; Physics, Applied
GA 488GR
UT ISI:000269337800016
ER
EF
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