-
1
-
-
0347666606
-
Diffusivities of Ar and Ne in carbon nanotubes
-
DOI 10.1080/0892702031000103239, PII NUE2W0W3F0XMU8Y6
-
D.M. Ackerman A.I. Skoulidas D.S. Sholl J.K. Johnson 2003 Diffusivities of Ar and Ne in carbon nanotubes Mol. Sim. 29 677 684 10.1080/ 0892702031000103239 1:CAS:528:DC%2BD3sXmsFaqs7o%3D (Pubitemid 44115088)
-
(2003)
Molecular Simulation
, vol.29
, Issue.10-11
, pp. 677-684
-
-
Ackerman, D.M.1
Skoulidas, A.I.2
Sholl, D.S.3
Johnson, J.K.4
-
2
-
-
33646400272
-
Theoretical and experimental investigation of morphology and temperature effects on adsorption of organic vapors in single-walled carbon nanotubes
-
10.1021/jp060040a 1:CAS:528:DC%2BD28XislOnsL8%3D
-
S. Agnihotri J.P.B. Mota M. Rostam-Abadi M.J. Rood 2006 Theoretical and experimental investigation of morphology and temperature effects on adsorption of organic vapors in single-walled carbon nanotubes J. Phys. Chem. B 110 7640 7647 10.1021/jp060040a 1:CAS:528:DC%2BD28XislOnsL8%3D
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 7640-7647
-
-
Agnihotri, S.1
Mota, J.P.B.2
Rostam-Abadi, M.3
Rood, M.J.4
-
3
-
-
31444449837
-
Binary and ternary adsorption of methane, ethane, and ethylene on titanosilicate ETS-10 zeolite
-
DOI 10.1021/je050364c
-
N.A. Al-Baghli K.F. Loughlin 2006 Binary and ternary adsorption of methane, ethane, and ethylene on titanosilicate ETS-10 zeolite J. Chem. Eng. Data 51 248 254 10.1021/je050364c 1:CAS:528:DC%2BD2MXht1ert7jI (Pubitemid 43151897)
-
(2006)
Journal of Chemical and Engineering Data
, vol.51
, Issue.1
, pp. 248-254
-
-
Al-Baghli, N.A.1
Loughlin, K.F.2
-
4
-
-
31644443306
-
Effects of confinement on freezing and melting
-
DOI 10.1088/0953-8984/18/6/R01, PII S0953898406577537
-
C. Alba-Simionesco B. Coasne G. Dosseh K.E. Gubbins R. Radhakrishnan M. Sliwinska-Bartkowiac 2006 Effects of confinement on freezing and melting J. Phys., Condens. Matter 18 R15 R68 10.1088/0953-8984/18/6/R01 1:CAS:528:DC%2BD28XisFams7c%3D (Pubitemid 43168233)
-
(2006)
Journal of Physics Condensed Matter
, vol.18
, Issue.6
-
-
Alba-Simionesco, C.1
Coasne, B.2
Dosseh, G.3
Dudziak, G.4
Gubbins, K.E.5
Radhakrishnan, R.6
Sliwinska-Bartkowiak, M.7
-
6
-
-
0038282875
-
Single-wall nanostructured carbon for methane storage
-
E. Bekyarova K. Murata M. Yudasaka D. Kasuya S. Iijima H. Tanaka H. Kahoh K. Kaneko 2003 Single-wall nanostructured carbon for methane storage J. Phys. Chem. B 20 4681 4684
-
(2003)
J. Phys. Chem. B
, vol.20
, pp. 4681-4684
-
-
Bekyarova, E.1
Murata, K.2
Yudasaka, M.3
Kasuya, D.4
Iijima, S.5
Tanaka, H.6
Kahoh, H.7
Kaneko, K.8
-
7
-
-
0342705993
-
Cobalt-catalysed growth of carbon nanotubes with single-atomic-layer walls
-
10.1038/363605a0 1:CAS:528:DyaK3sXltVOrs7s%3D
-
D.S. Bethune C.H. Kiang M.S.D. Vries G. Gorman R. Savoy J. Vasquez R. Beyers 1993 Cobalt-catalysed growth of carbon nanotubes with single-atomic-layer walls Nature 363 605 607 10.1038/363605a0 1:CAS:528:DyaK3sXltVOrs7s%3D
-
(1993)
Nature
, vol.363
, pp. 605-607
-
-
Bethune, D.S.1
Kiang, C.H.2
Vries, M.S.D.3
Gorman, G.4
Savoy, R.5
Vasquez, J.6
Beyers, R.7
-
8
-
-
2342643183
-
Further validation of a set of quadrupolar potential models for ethylene and propylene from the prediction of some binary mixture vapor-liquid equilibria by Gibbs-ensemble molecular simulation
-
DOI 10.1080/0892702031000103275, PII RQWFL9XHRLAXJBY7
-
J. Carrero-Mantilla M. Llano-Restrepo 2003 Further validation of a set of quadrupolar potential models for ethylene and propylene from the prediction of some binary mixture vapor-liquid equilibria by Gibbs-ensemble molecular simulation Mol. Sim. 29 549 554 10.1080/0892702031000103275 1:CAS:528: DC%2BD3sXmsFaqsLw%3D (Pubitemid 44115094)
-
(2003)
Molecular Simulation
, vol.29
, Issue.9
, pp. 549-554
-
-
Carrero-Mantilla, J.1
Llano-Restrepo, M.2
-
9
-
-
0033604674
-
Molecular simulation of the Joule-Thomson inversion curve of carbon dioxide
-
DOI 10.1016/S0378-3812(99)00264-2, PII S0378381299002642
-
A. Chacin J.M. Vazquez E.A. Müller 1999 Molecular simulation of the Joule-Thomson inversion curve of carbon monoxide F. Phase Eq. 165 147 155 10.1016/S0378-3812(99)00264-2 1:CAS:528:DyaK1MXnslCrsrc%3D (Pubitemid 30006336)
-
(1999)
Fluid Phase Equilibria
, vol.165
, Issue.2
, pp. 147-155
-
-
Chacin, A.1
Vazquez, J.M.2
Muller, E.A.3
-
10
-
-
0038360855
-
Adsorption equilibria of methane, ethane, ethylene, nitrogen, and hydrogen onto activated carbon
-
10.1021/je020161d 1:CAS:528:DC%2BD3sXit1KqtL0%3D
-
B.U. Choi D.-K. Choi Y.-W. Lee B.-K. Lee S.-H. Kim 2003 Adsorption equilibria of methane, ethane, ethylene, nitrogen, and hydrogen onto activated carbon J. Chem. Eng. Data 48 603 607 10.1021/je020161d 1:CAS:528: DC%2BD3sXit1KqtL0%3D
-
(2003)
J. Chem. Eng. Data
, vol.48
, pp. 603-607
-
-
Choi, B.U.1
Choi, D.-K.2
Lee, Y.-W.3
Lee, B.-K.4
Kim, S.-H.5
-
11
-
-
0000183270
-
Grand canonical Monte Carlo study of Lennard-Jones mixtures in slit pores. Part 3. Mixtures of two molecular fluids: Ethane and propane
-
R.F. Cracknell D. Nicholson 1994 Grand canonical Monte Carlo study of Lennard-Jones mixtures in slit pores. Part 3. Mixtures of two molecular fluids: ethane and propane J. Chem. Soc., Faraday Trans. 90 1497 1493
-
(1994)
J. Chem. Soc., Faraday Trans.
, vol.90
, pp. 1497-1493
-
-
Cracknell, R.F.1
Nicholson, D.2
-
12
-
-
33745506622
-
Modelling of ethane/ethylene separation using microporous carbon
-
DOI 10.1260/026361705777641972
-
S. Curbelo E.A. Müller 2005 Modelling of ethane/ethylene separation using microporous carbon Ads. Sci. Tech. 23 855 865 10.1260/026361705777641972 1:CAS:528:DC%2BD28XhtFegurfL (Pubitemid 43959968)
-
(2005)
Adsorption Science and Technology
, vol.23
, Issue.10
, pp. 855-865
-
-
Curbelo, S.1
Muller, E.A.2
-
13
-
-
0032910252
-
Adsorption equilibria and kinetics for propylene and propane over 13X and 4A zeolite pellets
-
10.1021/ie980640z
-
F.A. Da Silva A.E. Rodrigues 1999 Adsorption equilibria and kinetics for propylene and propane over 13X and 4A zeolite pellets Ind. Eng. Chem. Res. 38 2051 2057 10.1021/ie980640z
-
(1999)
Ind. Eng. Chem. Res.
, vol.38
, pp. 2051-2057
-
-
Da Silva, F.A.1
Rodrigues, A.E.2
-
14
-
-
0036466482
-
Review of hydrogen storage by adsorption in carbon nanotubes
-
DOI 10.1016/S0360-3199(01)00103-3, PII S0360319901001033
-
F.L. Darkrim P. Malbrunot G.P. Tartaglia 2002 Review of hydrogen storage by adsorption in carbon nanotubes Int. J. Hyd. Energy 27 193 202 10.1016/S0360-3199(01)00103-3 1:CAS:528:DC%2BD3MXoslOhtbo%3D (Pubitemid 33106970)
-
(2002)
International Journal of Hydrogen Energy
, vol.27
, Issue.2
, pp. 193-202
-
-
Lamari Darkrim, F.1
Malbrunot, P.2
Tartaglia, G.P.3
-
17
-
-
10444257235
-
Effects of potential models on the adsorption of ethane and ethylene on graphitized thermal carbon black. Study of two-dimensional critical temperature and isosteric heat versus loading
-
10.1021/la0486483
-
D.D. Do H.D. Do 2004 Effects of potential models on the adsorption of ethane and ethylene on graphitized thermal carbon black. Study of two-dimensional critical temperature and isosteric heat versus loading Langmuir 25 10889 10899 10.1021/la0486483
-
(2004)
Langmuir
, vol.25
, pp. 10889-10899
-
-
Do, D.D.1
Do, H.D.2
-
18
-
-
4344614438
-
Adsorption of ethylene on graphitized thermal carbon black and in slit pores: A computer simulation study
-
10.1021/la0495682 1:CAS:528:DC%2BD2cXlslert7k%3D
-
D.D. Do H.D. Do 2004 Adsorption of ethylene on graphitized thermal carbon black and in slit pores: a computer simulation study Langmuir 20 7103 7116 10.1021/la0495682 1:CAS:528:DC%2BD2cXlslert7k%3D
-
(2004)
Langmuir
, vol.20
, pp. 7103-7116
-
-
Do, D.D.1
Do, H.D.2
-
19
-
-
23944512991
-
Cooperative and competitive adsorption of ethylene, ethane, nitrogen and argon on graphitized carbon black and in slit pores
-
DOI 10.1007/s10450-005-1091-y
-
D.D. Do H.D. Do 2005 Cooperative and competitive adsorption of ethylene, ethane, nitrogen and argon on graphitized carbon black and in slit pores Adsorption 11 35 50 10.1007/s10450-005-1091-y 1:CAS:528:DC%2BD2MXntVGlsLo%3D (Pubitemid 41202483)
-
(2005)
Adsorption
, vol.11
, Issue.1
, pp. 35-50
-
-
Do, D.D.1
Do, H.D.2
-
20
-
-
0037059142
-
Molecular simulation of adsorption and transport diffusion of model fluids in carbon nanotubes
-
10.1080/0026897021000028429
-
T. Düren F.J. Keil N.A. Seaton 2002 Molecular simulation of adsorption and transport diffusion of model fluids in carbon nanotubes Mol. Phys. 100 3741 3751 10.1080/0026897021000028429
-
(2002)
Mol. Phys.
, vol.100
, pp. 3741-3751
-
-
Düren, T.1
Keil, F.J.2
Seaton, N.A.3
-
21
-
-
34548283073
-
Length-dependent optical effects in single-wall carbon nanotubes
-
DOI 10.1021/ja073115c
-
J.A. Fagan J.R. Simpson B.J. Bauer S.H. De Paoli Lacerda M.L. Becker J. Chun K.B. Migler A.R.H. Walker E.K. Hobbie 2007 Length-dependent optical effects in single-wall carbon nanotubes J. Am. Chem. Soc. 129 10607 10612 10.1021/ja073115c 1:CAS:528:DC%2BD2sXosVWitb8%3D (Pubitemid 47330282)
-
(2007)
Journal of the American Chemical Society
, vol.129
, Issue.34
, pp. 10607-10612
-
-
Fagan, J.A.1
Simpson, J.R.2
Bauer, B.J.3
Lacerda, S.H.D.P.4
Becker, M.L.5
Chun, J.6
Migler, K.B.7
Walker, A.R.H.8
Hobbie, E.K.9
-
22
-
-
25444462256
-
Shear viscosity and thermal conductivity of quadrupolar real fluids from molecular simulation
-
DOI 10.1080/08927020500252599
-
G.A. Fernández J. Vrabec H. Hasse 2005 Shear viscosity and thermal conductivity of quadrupolar real fluids from molecular simulation Mol. Sim. 31 787 793 10.1080/08927020500252599 (Pubitemid 41365747)
-
(2005)
Molecular Simulation
, vol.31
, Issue.11
, pp. 787-793
-
-
Fernandez, G.A.1
Vrabec, J.2
Hasse, H.3
-
23
-
-
25444435888
-
Self-diffusion and binary Maxwell-Stefan diffusion coefficients of quadrupolar real fluids from molecular simulation
-
10.1007/s10765-005-8093-6
-
G.A. Fernández J. Vrabec H. Hasse 2005 Self-diffusion and binary Maxwell-Stefan diffusion coefficients of quadrupolar real fluids from molecular simulation Int. J. Therm. 26 1389 1407 10.1007/s10765-005-8093-6
-
(2005)
Int. J. Therm.
, vol.26
, pp. 1389-1407
-
-
Fernández, G.A.1
Vrabec, J.2
Hasse, H.3
-
25
-
-
34250745826
-
Adsorption dynamics of alkanes on single-wall carbon nanotubes: A molecular beam scattering study
-
1:CAS:528:DC%2BD2sXltFWrsb4%3D
-
S. Funk U. Burghaus B. White S. O'Brien N.J. Turro 2007 Adsorption dynamics of alkanes on single-wall carbon nanotubes: a molecular beam scattering study J. Phys. Chem. C 111 8043 8049 1:CAS:528:DC%2BD2sXltFWrsb4%3D
-
(2007)
J. Phys. Chem. C
, vol.111
, pp. 8043-8049
-
-
Funk, S.1
Burghaus, U.2
White, B.3
O'Brien, S.4
Turro, N.J.5
-
26
-
-
0004215006
-
Phase separation in confined systems
-
10.1088/0034-4885/62/12/201 1:CAS:528:DC%2BD3cXjvFalug%3D%3D
-
L.D. Gelb K.E. Gubbins R. Radhakrishnan M. Sliwinska-Bartkowiak 1999 Phase separation in confined systems Rep. Prog. Phys. 62 1573 1659 10.1088/0034-4885/62/12/201 1:CAS:528:DC%2BD3cXjvFalug%3D%3D
-
(1999)
Rep. Prog. Phys.
, vol.62
, pp. 1573-1659
-
-
Gelb, L.D.1
Gubbins, K.E.2
Radhakrishnan, R.3
Sliwinska-Bartkowiak, M.4
-
28
-
-
72449126206
-
Co-adsorption equilibrium of ethane and ethylene mixture onto various activated carbons
-
Italy
-
Guo, J., Bao, X.T., Gui, B., Xiang, S.X., Li, S.R., Huang, X.F., Heslop, M.J.: Co-adsorption equilibrium of ethane and ethylene mixture onto various activated carbons. Paper presented in FOA9 Naxos, Italy, 2007
-
(2007)
FOA9 Naxos
-
-
Guo, J.1
Bao, X.T.2
Gui, B.3
Xiang, S.X.4
Li, S.R.5
Huang, X.F.6
Heslop, M.J.7
-
29
-
-
0037135019
-
Study of molecular shape and non-ideality effects on mixture adsorption isotherms of small molecules in carbon nanotubes: A grand canonical Monte Carlo simulation study
-
DOI 10.1016/S0009-2509(02)00131-8, PII S0009250902001318
-
A. Heyden T. Düren F.J. Keil 2002 Study of molecular shape and non-ideality effects on mixture adsorption isotherms of small molecules in carbon nanotubes: a grand canonical Monte Carlo simulation study Chem. Eng. Sci. 57 2439 2448 10.1016/S0009-2509(02)00131-8 1:CAS:528:DC%2BD38XkvFCiu78%3D (Pubitemid 34866045)
-
(2002)
Chemical Engineering Science
, vol.57
, Issue.13
, pp. 2439-2448
-
-
Heyden, A.1
Duren, T.2
Keil, F.J.3
-
30
-
-
34548721012
-
Atomic-scale detection of organic molecules coupled to single-walled carbon nanotubes
-
DOI 10.1021/ja069080i
-
S.Y. Hong G. Tobias B. Ballesteros F.E. Oualid J.C. Errey K. Doores A.I. Kirkland P.D. Nellist M.L.H. Green B.G. Davis 2007 Atomic-scale detection of organic molecules coupled to single-walled carbon nanotubes J. Am. Chem. Soc. 129 10966 10967 10.1021/ja069080i 1:CAS:528:DC%2BD2sXptVaqu7g%3D (Pubitemid 47435670)
-
(2007)
Journal of the American Chemical Society
, vol.129
, Issue.36
, pp. 10966-10967
-
-
Sung, Y.H.1
Tobias, G.2
Ballesteros, B.3
El Oualid, F.4
Errey, J.C.5
Doores, K.J.6
Kirkland, A.I.7
Nellist, P.D.8
Green, M.L.H.9
Davis, B.G.10
-
31
-
-
20844441126
-
Molecular modeling of freezing of simple fluids confined within carbon nanotubes
-
DOI 10.1063/1.1881072, 144706
-
F.R. Hung B. Coasne E.E. Santiso K.E. Gubbins F.R. Siperstein M. Sliwinska-Bartkowiak 2005 Molecular modeling of freezing of simple fluids confined within carbon nanotubes J. Chem. Phys. 122 144706(144701) 144706(144714) 10.1063/1.1881072 (Pubitemid 40858332)
-
(2005)
Journal of Chemical Physics
, vol.122
, Issue.14
, pp. 1-14
-
-
Hung, F.R.1
Coasne, B.2
Santiso, E.E.3
Gubbins, K.E.4
Siperstein, F.R.5
Sliwinska-Bartkowiak, M.6
-
32
-
-
0342819025
-
Helical microtubules of graphitic carbon
-
10.1038/354056a0 1:CAS:528:DyaK38Xmt1Ojtg%3D%3D
-
S. Iijima 1991 Helical microtubules of graphitic carbon Nature 354 56 58 10.1038/354056a0 1:CAS:528:DyaK38Xmt1Ojtg%3D%3D
-
(1991)
Nature
, vol.354
, pp. 56-58
-
-
Iijima, S.1
-
33
-
-
0038033665
-
Single-shell carbon nanotubes of 1-nm diameter
-
10.1038/363603a0 1:CAS:528:DyaK3sXltVOrs7o%3D
-
S. Iijima T. Ichihashi 1993 Single-shell carbon nanotubes of 1-nm diameter Nature 363 603 605 10.1038/363603a0 1:CAS:528:DyaK3sXltVOrs7o%3D
-
(1993)
Nature
, vol.363
, pp. 603-605
-
-
Iijima, S.1
Ichihashi, T.2
-
34
-
-
84939775172
-
Reporting physisorption data for gas/solid isotherms
-
IUPAC. 10.1351/pac198557040603
-
IUPAC 1985 Reporting physisorption data for gas/solid isotherms Pure Appl. Chem. 57 603 619 10.1351/pac198557040603
-
(1985)
Pure Appl. Chem.
, vol.57
, pp. 603-619
-
-
-
35
-
-
33748582261
-
Capillary phase transitions of linear and branched alkanes in carbon nanotubes from molecular simulation
-
DOI 10.1021/la0608720
-
J. Jiang S.I. Sandler 2006 Capillary phase transitions of linear and branched alkanes in carbon nanotubes from molecular simulation Langmuir 22 7391 7399 10.1021/la0608720 1:CAS:528:DC%2BD28XmslGrsLg%3D (Pubitemid 44366443)
-
(2006)
Langmuir
, vol.22
, Issue.17
, pp. 7391-7399
-
-
Jiang, J.1
Sandler, S.I.2
-
36
-
-
8344267563
-
A Monte Carlo simulation study of the effect of carbon topology on nitrogen adsorption on graphite, a nanotube bundle, C60 fullerite, C168 schwarzite, and a nanoporous carbon
-
10.1039/b409116g 1:CAS:528:DC%2BD2cXntFOktr8%3D
-
J. Jiang N.J. Wagner S.I. Sandler 2004 A Monte Carlo simulation study of the effect of carbon topology on nitrogen adsorption on graphite, a nanotube bundle, C60 fullerite, C168 schwarzite, and a nanoporous carbon Phys. Chem. Chem. Phys. 6 4440 4444 10.1039/b409116g 1:CAS:528:DC%2BD2cXntFOktr8%3D
-
(2004)
Phys. Chem. Chem. Phys.
, vol.6
, pp. 4440-4444
-
-
Jiang, J.1
Wagner, N.J.2
Sandler, S.I.3
-
37
-
-
33749233586
-
Adsorption and separation of linear and branched alkanes on carbon nanotube bundles from configurational-bias Monte Carlo simulation
-
DOI 10.1103/PhysRevB.72.045447, 045447
-
J. Jiang S.I. Sandler M. Schenk B. Smit 2005 Adsorption and separation of linear and branched alkanes on carbon nanotube bundles from configurational-bias Monte Carlo simulation Phys. Rev. B 72 45447 10.1103/PhysRevB.72.045447 (Pubitemid 41528771)
-
(2005)
Physical Review B - Condensed Matter and Materials Physics
, vol.72
, Issue.4
, pp. 1-11
-
-
Jiang, J.1
Sandler, S.I.2
Schenk, M.3
Smit, B.4
-
38
-
-
0029912748
-
Development and testing of the OPLS all-atom force field on conformational energetics and properties of organic liquids
-
DOI 10.1021/ja9621760, PII S0002786396021762
-
W.L. Jorgensen D.S. Maxwell J. Tirado-Rives 1996 Development and testing of the OPLS all-atom force field on conformational energetics and properties of organic liquids J. Am. Chem. Soc. 118 11225 11236 10.1021/ja9621760 1:CAS:528:DyaK28XmtlOitrs%3D (Pubitemid 26399746)
-
(1996)
Journal of the American Chemical Society
, vol.118
, Issue.45
, pp. 11225-11236
-
-
Jorgensen, W.L.1
Maxwell, D.S.2
Tirado-Rives, J.3
-
39
-
-
0028736652
-
Nitrogen adsorption in slit pores at ambient temperatures: Comparison of simulation and experiment
-
10.1021/la00024a036
-
K. Kaneko R.F. Cracknell D. Nicholson 1994 Nitrogen adsorption in slit pores at ambient temperatures: comparison of simulation and experiment Langmuir 10 4506 4609 10.1021/la00024a036
-
(1994)
Langmuir
, vol.10
, pp. 4506-4609
-
-
Kaneko, K.1
Cracknell, R.F.2
Nicholson, D.3
-
40
-
-
72449147371
-
Adsorption and diffusion of alkanes and alkenes in carbon nanotubes
-
Salt Lake City, USA
-
Keil, F.J., Jakobtorweihen, S.: Adsorption and diffusion of alkanes and alkenes in carbon nanotubes. Paper presented in AIChE Annual Meeting Salt Lake City, USA, 2007
-
(2007)
AIChE Annual Meeting
-
-
Keil, F.J.1
Jakobtorweihen, S.2
-
41
-
-
0032761485
-
Computer simulations of dependence of adsorption characteristics of ethane on the size of graphite micropores
-
10.1021/la9801817 1:CAS:528:DyaK1cXotFChtb0%3D
-
A.V. Klochko E.N. Brodskaya E.M. Piotrovskaya 1999 Computer simulations of dependence of adsorption characteristics of ethane on the size of graphite micropores Langmuir 15 545 552 10.1021/la9801817 1:CAS:528:DyaK1cXotFChtb0%3D
-
(1999)
Langmuir
, vol.15
, pp. 545-552
-
-
Klochko, A.V.1
Brodskaya, E.N.2
Piotrovskaya, E.M.3
-
42
-
-
28144447473
-
Observation of a one-dimensional adsorption site on carbon nanotubes: Adsorption of alkanes of different molecular lengths
-
10.1021/jp0582078 1:CAS:528:DC%2BD2MXhtFWrsrvP
-
P. Kondratyuk Y. Wang J.K. Johnson J.T. Yates Jr. 2005 Observation of a one-dimensional adsorption site on carbon nanotubes: adsorption of alkanes of different molecular lengths J. Phys. Chem. B 109 20999 21005 10.1021/jp0582078 1:CAS:528:DC%2BD2MXhtFWrsrvP
-
(2005)
J. Phys. Chem. B
, vol.109
, pp. 20999-21005
-
-
Kondratyuk, P.1
Wang, Y.2
Johnson, J.K.3
Yates Jr., J.T.4
-
44
-
-
34547817694
-
A multi-step strategy for cutting and purification of single-walled carbon nanotubes
-
DOI 10.1016/j.carbon.2007.06.009, PII S0008622307002497
-
Y. Liu L. Gao J. Sun S. Zheng L. Jiang Y. Wang H. Kajiura Y. Li K. Noda 2007 A multi-step strategy for cutting and purification of single-walled carbon nanotubes Carbon 45 1972 1978 10.1016/j.carbon.2007.06.009 1:CAS:528: DC%2BD2sXovFeit7o%3D (Pubitemid 47238068)
-
(2007)
Carbon
, vol.45
, Issue.10
, pp. 1972-1978
-
-
Liu, Y.1
Gao, L.2
Sun, J.3
Zheng, S.4
Jiang, L.5
Wang, Y.6
Kajiura, H.7
Li, Y.8
Noda, K.9
-
45
-
-
36749084620
-
Temperature-driven pumping of fluid through single-walled carbon nanotubes
-
DOI 10.1021/nl071537e
-
M.J. Longhurst N. Quirke 2007 Temperature-driven pumping of fluid through single-walled carbon nanotubes Nano Lett. 7 3324 3328 10.1021/nl071537e 1:CAS:528:DC%2BD2sXhtFGnsL%2FK (Pubitemid 350216024)
-
(2007)
Nano Letters
, vol.7
, Issue.11
, pp. 3324-3328
-
-
Longhurst, M.J.1
Quirke, N.2
-
46
-
-
33745741108
-
Carbon nanotubes with small and tunable diameters from poly(ferrocenylsilane)-block-polysiloxane diblock copolymers
-
DOI 10.1021/la053308i
-
J.Q. Lu D.A. Rider E. Onyegam H. Wang M.A. Winnik I. Manners Q. Cheng Q. Fu J. Liu 2006 Carbon nanotubes with small and tunable diameters from poly(ferrocenylsilane)-block-polysiloxane diblock copolymers Langmuir 22 5174 5179 10.1021/la053308i 1:CAS:528:DC%2BD28XjvVWnsr8%3D (Pubitemid 44012087)
-
(2006)
Langmuir
, vol.22
, Issue.11
, pp. 5174-5179
-
-
Lu, J.Q.1
Rider, D.A.2
Onyegam, E.3
Wang, H.4
Winnik, M.A.5
Manners, I.6
Cheng, Q.7
Fu, Q.8
Liu, J.9
-
47
-
-
0035954945
-
Separation of organic molecular mixtures in carbon nanotubes and bundles: Molecular dynamics simulations
-
DOI 10.1021/jp0103272
-
Z. Mao S.B. Sinnott 2001 Separation of organic molecular mixtures in carbon nanotubes and bundles: molecular dynamics simulations J. Phys. Chem. B 105 6916 6924 10.1021/jp0103272 1:CAS:528:DC%2BD3MXksFOmuro%3D (Pubitemid 35338982)
-
(2001)
Journal of Physical Chemistry B
, vol.105
, Issue.29
, pp. 6916-6924
-
-
Mao, Z.1
Sinnott, S.B.2
-
48
-
-
0001127721
-
Free energies of solvation in chloroform and water from a linear response approach
-
10.1002/(SICI)1099-1395(199707)10:7<563::AID-POC912>3.0.CO;2-0 1:CAS:528:DyaK2sXmt1Wku7w%3D
-
N.A. McDonald H.A. Carlson W.L. Jorgensen 1997 Free energies of solvation in chloroform and water from a linear response approach J. Phys. Org. Chem. 10 563 576 10.1002/(SICI)1099-1395(199707)10:7<563::AID-POC912>3.0.CO;2-0 1:CAS:528:DyaK2sXmt1Wku7w%3D
-
(1997)
J. Phys. Org. Chem.
, vol.10
, pp. 563-576
-
-
McDonald, N.A.1
Carlson, H.A.2
Jorgensen, W.L.3
-
50
-
-
34047100404
-
Strong correlations and Fickian water diffusion in narrow carbon nanotubes
-
DOI 10.1063/1.2565806
-
B. Mukherjee P.K. Maiti C. Dasgupta A.K. Sood 2007 Strong correlations and Fickian water diffusion in narrow carbon nanotubes J. Chem. Phys. 126 124704 124711 10.1063/1.2565806 (Pubitemid 46517160)
-
(2007)
Journal of Chemical Physics
, vol.126
, Issue.12
, pp. 124704
-
-
Mukherjee, B.1
Maiti, P.K.2
Dasgupta, C.3
Sood, A.K.4
-
52
-
-
0004217488
-
-
NIST (2008). Chemistry Webbook. http://webbook.nist.gov
-
(2008)
Chemistry Webbook
-
-
-
53
-
-
19844366933
-
Separations research needs for the 21st century
-
DOI 10.1021/ie0501475
-
R.D. Noble R. Agrawal 2005 Separations research needs for the 21st century Ind. Eng. Chem. Res. 44 2887 2892 10.1021/ie0501475 1:CAS:528: DC%2BD2MXit1Oit7o%3D (Pubitemid 40763415)
-
(2005)
Industrial and Engineering Chemistry Research
, vol.44
, Issue.9
, pp. 2887-2892
-
-
Noble, R.D.1
Agrawal, R.2
-
54
-
-
34547809547
-
A unified formulation of the constant temperature molecular dynamics methods
-
10.1063/1.447334
-
S. Nosé 1984 A unified formulation of the constant temperature molecular dynamics methods J. Chem. Phys. 81 511 519 10.1063/1.447334
-
(1984)
J. Chem. Phys.
, vol.81
, pp. 511-519
-
-
Nosé, S.1
-
55
-
-
0037173858
-
2 adsorption
-
DOI 10.1021/jp014604g
-
2 adsorption J. Phys. Chem. B 106 7171 7176 10.1021/jp014604g 1:CAS:528:DC%2BD38XksVeit7s%3D (Pubitemid 35390087)
-
(2002)
Journal of Physical Chemistry B
, vol.106
, Issue.29
, pp. 7171-7176
-
-
Ohba, T.1
Kaneko, K.2
-
59
-
-
0001578578
-
Molecular simulation of hydrogen adsorption in charged single-walled carbon nanotubes
-
10.1063/1.480313 1:CAS:528:DyaK1MXnsVaqsbg%3D
-
V.V. Simonyan P. Diep J.K. Johnson 1999 Molecular simulation of hydrogen adsorption in charged single-walled carbon nanotubes J. Chem. Phys. 111 9778 9783 10.1063/1.480313 1:CAS:528:DyaK1MXnsVaqsbg%3D
-
(1999)
J. Chem. Phys.
, vol.111
, pp. 9778-9783
-
-
Simonyan, V.V.1
Diep, P.2
Johnson, J.K.3
-
60
-
-
0035280888
-
Molecular simulation of xenon adsorption on single-walled carbon nanotubes
-
DOI 10.1063/1.1344234
-
V.V. Simonyan J.K. Johnson A. Kuznetsova J.T. Yates 2001 Molecular simulation of xenon adsorption on single-walled carbon nanotubes J. Chem. Phys. 114 4180 4185 10.1063/1.1344234 1:CAS:528:DC%2BD3MXhsVWgs78%3D (Pubitemid 32255042)
-
(2001)
Journal of Chemical Physics
, vol.114
, Issue.9
, pp. 4180-4185
-
-
Simonyan, V.V.1
Johnson, J.K.2
Kuznetsova, A.3
Yates Jr., J.T.4
-
61
-
-
0034749019
-
Carbon nanotubes: Synthesis, properties, and applications
-
10.1080/20014091104189 1:CAS:528:DC%2BD3MXnsFCqur4%3D
-
S.B. Sinnott R. Andrews 2001 Carbon nanotubes: synthesis, properties, and applications Crit. Rev. Sol. State Mat. Sci. 26 145 249 10.1080/20014091104189 1:CAS:528:DC%2BD3MXnsFCqur4%3D
-
(2001)
Crit. Rev. Sol. State Mat. Sci.
, vol.26
, pp. 145-249
-
-
Sinnott, S.B.1
Andrews, R.2
-
62
-
-
32044469411
-
Adsorption and diffusion of carbon dioxide and nitrogen through single-walled carbon nanotube membranes
-
DOI 10.1063/1.2151173, 054708
-
A.I. Skoulidas D.S. Sholl J.K. Johnson 2006 Adsorption and diffusion of carbon dioxide and nitrogen through single-walled carbon nanotube membranes J. Chem. Phys. 124 54708(54701) 54708(54707) 10.1063/1.2151173 (Pubitemid 43202716)
-
(2006)
Journal of Chemical Physics
, vol.124
, Issue.5
, pp. 1-7
-
-
Skoulidas, A.I.1
Sholl, D.S.2
Johnson, J.K.3
-
63
-
-
34548379443
-
A short description of DL-POLY
-
DOI 10.1080/08927020600939830, PII 771050711
-
W. Smith I.T. Todorov 2006 A short description of DL-POLY Mol. Sim. 32 935 943 10.1080/08927020600939830 1:CAS:528:DC%2BD28XhtlCms7%2FJ (Pubitemid 47355420)
-
(2006)
Molecular Simulation
, vol.32
, Issue.12-13
, pp. 935-943
-
-
Smith, W.1
Todorov, I.T.2
-
65
-
-
36049024999
-
The physical interactions of gases with crystalline solids
-
10.1016/0039-6028(73)90264-1 1:CAS:528:DyaE3sXhtVagtrk%3D
-
W.A. Steele 1973 The physical interactions of gases with crystalline solids Surf. Sci. 36 317 352 10.1016/0039-6028(73)90264-1 1:CAS:528: DyaE3sXhtVagtrk%3D
-
(1973)
Surf. Sci.
, vol.36
, pp. 317-352
-
-
Steele, W.A.1
-
67
-
-
12044258669
-
Molecular interactions for physical adsorption
-
10.1021/cr00023a002 1:CAS:528:DyaK3sXmtlCluro%3D
-
W.A. Steele 1993 Molecular interactions for physical adsorption Chem. Rev. 93 2355 2378 10.1021/cr00023a002 1:CAS:528:DyaK3sXmtlCluro%3D
-
(1993)
Chem. Rev.
, vol.93
, pp. 2355-2378
-
-
Steele, W.A.1
-
68
-
-
0041324673
-
Vapor-liquid equilibria of mixtures containing nitrogen, oxygen, carbon dioxide, and ethane
-
DOI 10.1002/aic.690490826
-
J. Stoll J. Vrabec H. Hasse 2003 Vapor-liquid equilibria of mixtures containing nitrogen, oxygen, carbon dioxide, and ethane AIChE J. 49 2187 2198 10.1002/aic.690490826 1:CAS:528:DC%2BD3sXmsFGqu7g%3D (Pubitemid 36999459)
-
(2003)
AIChE Journal
, vol.49
, Issue.8
, pp. 2187-2198
-
-
Stoll, J.1
Vrabec, J.2
Hasse, H.3
-
69
-
-
23744457494
-
Water in carbon nanotubes: Adsorption isotherms and thermodynamic properties from molecular simulation
-
DOI 10.1063/1.1924697, 234712
-
A. Striolo A.A. Chialvo K.E. Gubbins P.T. Cummings 2005 Water in carbon nanotubes: adsorption isotherms and thermodynamic properties from molecular simulation J. Chem. Phys. 122 234712(234711) 234712(234714) 10.1063/1.1924697 (Pubitemid 41134492)
-
(2005)
Journal of Chemical Physics
, vol.122
, Issue.23
, pp. 1-14
-
-
Striolo, A.1
Chialvo, A.A.2
Gubbins, K.E.3
Cummings, P.T.4
-
70
-
-
33748763285
-
Analysis of gas adsorption in Kureha active carbon based on the slit-pore model and Monte-Carlo simulations
-
DOI 10.1080/08927020600717095, PII U742329156331X32
-
M.B. Sweatman N. Quirke W. Zhu F. Kapteijn 2006 Analysis of gas adsorption in kureha active carbon based on the slit-pore model and Monte-Carlo simulations Mol. Sim. 32 513 522 10.1080/08927020600717095 1:CAS:528: DC%2BD28XpsVOkur0%3D (Pubitemid 44410478)
-
(2006)
Molecular Simulation
, vol.32
, Issue.7
, pp. 513-522
-
-
Sweatman, M.B.1
Quirke, N.2
Zhu, W.3
Kapteijn, F.4
-
71
-
-
34547269885
-
Structural relationship between degree of unsaturation with polarizability of (5,5) armchair single-wall carbon nanotubes
-
DOI 10.1080/15363830701423674, PII 780433211
-
A. Taherpour 2007 Structural relationship between degree of unsaturation with polarizability of (5,5) armchair single-wall carbon nanotubes Nanotubes Carbon Nanostruct. 15 279 289 10.1080/15363830701423674 1:CAS:528: DC%2BD2sXntlaisb8%3D (Pubitemid 47151219)
-
(2007)
Fullerenes Nanotubes and Carbon Nanostructures
, vol.15
, Issue.4
, pp. 279-289
-
-
Taherpour, A.1
-
72
-
-
2142813682
-
Computer simulation of molecular dynamics: Methodology, applications, and perspectives in chemistry
-
10.1002/anie.199009921
-
W.F. van Gunsteren H.J.C. Berendsen 1990 Computer simulation of molecular dynamics: methodology, applications, and perspectives in chemistry Angew. Chem. Int. Ed. Engl. 29 992 1023 10.1002/anie.199009921
-
(1990)
Angew. Chem. Int. Ed. Engl.
, vol.29
, pp. 992-1023
-
-
Van Gunsteren, W.F.1
Berendsen, H.J.C.2
-
73
-
-
22944467757
-
Computer "experiments" on classical fluids. Thermodynamical properties of Lennard-Jones molecules
-
10.1103/PhysRev.159.98 1:CAS:528:DyaF2sXks1Orsrc%3D
-
L. Verlet 1967 Computer "Experiments" on classical fluids. Thermodynamical properties of Lennard-Jones molecules Phys. Rev. 159 98 103 10.1103/PhysRev.159.98 1:CAS:528:DyaF2sXks1Orsrc%3D
-
(1967)
Phys. Rev.
, vol.159
, pp. 98-103
-
-
Verlet, L.1
-
74
-
-
0026626824
-
The electrostatic field at a graphite surface and its effect on molecule-solid interactions
-
10.1021/la00037a029 1:CAS:528:DyaK38Xks1yjuw%3D%3D
-
A. Vernov W.A. Steele 1992 The electrostatic field at a graphite surface and its effect on molecule-solid interactions Langmuir 8 155 159 10.1021/la00037a029 1:CAS:528:DyaK38Xks1yjuw%3D%3D
-
(1992)
Langmuir
, vol.8
, pp. 155-159
-
-
Vernov, A.1
Steele, W.A.2
-
75
-
-
0035818699
-
A set of molecular models for symmetric quadrupolar fluids
-
DOI 10.1021/jp012542o
-
J. Vrabec J. Stoll H. Hasse 2001 A set of molecular models for symmetric quadrupolar fluids J. Phys. Chem. B 105 12126 12133 10.1021/jp012542o 1:CAS:528:DC%2BD3MXnvFGnurc%3D (Pubitemid 35338370)
-
(2001)
Journal of Physical Chemistry B
, vol.105
, Issue.48
, pp. 12126-12133
-
-
Vrabec, J.1
Stoll, J.2
Hasse, H.3
-
76
-
-
17844390127
-
Prediction of Joule-Thomson inversion curves for pure fluids and one mixture by molecular simulation
-
DOI 10.1016/j.cryogenics.2004.10.006, PII S0011227504002267
-
J. Vrabec G.K. Kedia H. Hasse 2005 Prediction of Joule-Thomson inversion curves for pure fluids and one mixture by molecular simulation Cryogenics 45 253 258 10.1016/j.cryogenics.2004.10.006 1:CAS:528:DC%2BD2MXitlCjsrk%3D (Pubitemid 40583923)
-
(2005)
Cryogenics
, vol.45
, Issue.4
, pp. 253-258
-
-
Vrabec, J.1
Kedia, G.K.2
Hasse, H.3
-
77
-
-
0014995389
-
Thermodynamics and structural properties of liquid ionic salts obtained by Monte Carlo computation
-
10.1039/tf9716700012 1:CAS:528:DyaE3MXlsl2nsg%3D%3D
-
L.V. Woodcock K. Singer 1971 Thermodynamics and structural properties of liquid ionic salts obtained by Monte Carlo computation Trans. Farad. Soc. 67 12 30 10.1039/tf9716700012 1:CAS:528:DyaE3MXlsl2nsg%3D%3D
-
(1971)
Trans. Farad. Soc.
, vol.67
, pp. 12-30
-
-
Woodcock, L.V.1
Singer, K.2
-
79
-
-
33645519089
-
Utilizing polymers for shaping the interfacial behavior of carbon nanotubes
-
10.1039/b513344k 1:CAS:528:DC%2BD28Xjt1Kitrk%3D
-
R. Yerushalmi-Rozen I. Szleifer 2006 Utilizing polymers for shaping the interfacial behavior of carbon nanotubes Soft. Matter. 2 24 28 10.1039/b513344k 1:CAS:528:DC%2BD28Xjt1Kitrk%3D
-
(2006)
Soft. Matter.
, vol.2
, pp. 24-28
-
-
Yerushalmi-Rozen, R.1
Szleifer, I.2
-
80
-
-
11844257610
-
An effective potential for adsorption of polar molecules on graphite
-
DOI 10.1080/0892702042000272889
-
X. Zhao J.K. Johnson 2005 An effective potential for adsorption of polar molecules on graphite Mol. Sim. 31 1 10 10.1080/0892702042000272889 (Pubitemid 40086809)
-
(2005)
Molecular Simulation
, vol.31
, Issue.1
, pp. 1-10
-
-
Zhao, X.1
Johnson, J.K.2
|