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Volumn 6, Issue 3, 2014, Pages 268-279

Torsional Characteristics of SingleWalled Carbon Nanotube with Water Interactions by Using Molecular Dynamics Simulation

Author keywords

Carbon nanotube; Molecular dynamics; Nano fluid; Torsion; Water encapsulation; Water interaction

Indexed keywords

CARBON NANOTUBES; DEFECTS; FLUIDIC DEVICES; MOLECULAR DYNAMICS; MOLECULES; NANOTUBES; STEREOCHEMISTRY; TORSIONAL STRESS;

EID: 84958757903     PISSN: 23116706     EISSN: 21505551     Source Type: Journal    
DOI: 10.1007/BF03353791     Document Type: Article
Times cited : (33)

References (39)
  • 1
    • 84866982432 scopus 로고    scopus 로고
    • Recent advances in directed assembly of nanowires or nanotubes
    • M. Liu, Z. Wu, W. M. Lau and J. Yang, “Recent advances in directed assembly of nanowires or nanotubes”, Nano-Micro Lett. 4(3), 142–153 (2012). http://dx.doi.org/10.3786/nml.v4i3.p142-153
    • (2012) Nano-Micro Lett. , vol.4 , Issue.3 , pp. 142-153
    • Liu, M.1    Wu, Z.2    Lau, W.M.3    Yang, J.4
  • 2
    • 84881171555 scopus 로고    scopus 로고
    • Shear deformation characteristics of single walled carbon nanotube with water interactions by using molecular dynamics simulation
    • V. Vijayaraghavan and C. H. Wong, “Shear deformation characteristics of single walled carbon nanotube with water interactions by using molecular dynamics simulation”, Phys. E: Low-Dimensional Systems and Nanostructures 54 (0), 206–213 (2013). http://dx.doi.org/http://dx.doi.org/10.1016/j.physe.2013.06.025
    • (2013) Phys. E: Low-Dimensional Systems and Nanostructures , vol.54 , pp. 206-213
    • Vijayaraghavan, V.1    Wong, C.H.2
  • 3
    • 0037415839 scopus 로고    scopus 로고
    • Fabrication of nanometer-scale mechanical devices incorporating individual multiwalled carbon nanotubes as torsional springs
    • P. A. Williams, S. J. Papadakis, A. M. Patel, M. R. Falvo, S. Washburn and R. Superfine, “Fabrication of nanometer-scale mechanical devices incorporating individual multiwalled carbon nanotubes as torsional springs”, Appl. Phys. Lett. 82(5), 805–807 (2003). http://dx.doi.org/10.1063/1.1538346
    • (2003) Appl. Phys. Lett. , vol.82 , Issue.5 , pp. 805-807
    • Williams, P.A.1    Papadakis, S.J.2    Patel, A.M.3    Falvo, M.R.4    Washburn, S.5    Superfine, R.6
  • 4
    • 84958773917 scopus 로고    scopus 로고
    • Advances in conceptual electronic nanode-vices based on 0D and 1D nanomaterials
    • Y. Zhang, L. F. Duan, J. Wang, H. Geng and Q. Zhang, “Advances in conceptual electronic nanode-vices based on 0D and 1D nanomaterials”, Nano-Micro Lett. 6(1), 1–19 (2014). http://dx.doi.org/10.5101/nml.v6i1.p1-19
    • (2014) Nano-Micro Lett. , vol.6 , Issue.1 , pp. 1-19
    • Zhang, Y.1    Duan, L.F.2    Wang, J.3    Geng, H.4    Zhang, Q.5
  • 5
    • 65149098987 scopus 로고    scopus 로고
    • Molecular-dynamics studies of competitive replacement in peptide-nanotube assembly for control of drug release
    • Y. Cheng, Q. X. Pei and H. J. Gao, “Molecular-dynamics studies of competitive replacement in peptide-nanotube assembly for control of drug release”, Nanotechnology 20(14), 145101 (2009). http://dx.doi.org/10.1088/0957-4484/20/14/145101
    • (2009) Nanotechnology , vol.20 , Issue.14 , pp. 145101
    • Cheng, Y.1    Pei, Q.X.2    Gao, H.J.3
  • 6
    • 84867511009 scopus 로고    scopus 로고
    • Micro and nanotechnology for intracellular delivery therapy protein
    • D. Xu, Z. Hu, J. Su, F. Wu and W. Yuan, “Micro and nanotechnology for intracellular delivery therapy protein”, Nano-Micro Lett. 4(2), 118–123 (2012). http://dx.doi.org/10.3786/nml.v4i2.p118-123
    • (2012) Nano-Micro Lett. , vol.4 , Issue.2 , pp. 118-123
    • Xu, D.1    Hu, Z.2    Su, J.3    Wu, F.4    Yuan, W.5
  • 7
    • 84887561500 scopus 로고    scopus 로고
    • A novel immunosensor based on Au nanoparticles and polyaniline/multiwall carbon nanotubes/chitosan nanocomposite film functionalized interface
    • X. Sun, L. Qiao and X. Wang, “A novel immunosensor based on Au nanoparticles and polyaniline/multiwall carbon nanotubes/chitosan nanocomposite film functionalized interface”, Nano-Micro Lett. 5(3), 191–201 (2013). http://dx.doi.org/10.5101/nml.v5i3.p191-201
    • (2013) Nano-Micro Lett. , vol.5 , Issue.3 , pp. 191-201
    • Sun, X.1    Qiao, L.2    Wang, X.3
  • 8
    • 84869385387 scopus 로고    scopus 로고
    • Nanobiocomposite electrochemical biosensor utilizing synergic action of neutral red functionalized carbon nanotubes
    • D. R. Shobha Jeykumari, R. A. Kalaivani and S. Sriman Narayanan, “Nanobiocomposite electrochemical biosensor utilizing synergic action of neutral red functionalized carbon nanotubes”, Nano-Micro Lett. 4(4), 220–227 (2012). http://dx.doi.org/10.3786/nml.v4i4.p220-227
    • (2012) Nano-Micro Lett. , vol.4 , Issue.4 , pp. 220-227
    • Shobha Jeykumari, D.R.1    Kalaivani, R.A.2    Narayanan, S.S.3
  • 9
    • 33745661039 scopus 로고    scopus 로고
    • Experimental measurement of single-wall carbon nanotube torsional properties
    • A. R. Hall, L. An, J. Liu, L. Vicci, M. R. Falvo, R. Superfine and S. Washburn, “Experimental measurement of single-wall carbon nanotube torsional properties”, Phys. Rev. Lett. 96(25), 256102 (2006). http://dx.doi.org/10.1103/PhysRevLett.96.256102
    • (2006) Phys. Rev. Lett. , vol.96 , Issue.25 , pp. 256102
    • Hall, A.R.1    An, L.2    Liu, J.3    Vicci, L.4    Falvo, M.R.5    Superfine, R.6    Washburn, S.7
  • 10
    • 9144242003 scopus 로고    scopus 로고
    • Atomistic simulation of the torsion deformation of carbon nanotubes
    • Y. Wang, X. X. Wang and X. G. Ni, “Atomistic simulation of the torsion deformation of carbon nanotubes”, Modelling Simul. Mater. Sci. Eng. 12(6), 1099–1107 (2004). http://dx.doi.org/10.1088/0965-0393/12/6/004
    • (2004) Modelling Simul. Mater. Sci. Eng. , vol.12 , Issue.6 , pp. 1099-1107
    • Wang, Y.1    Wang, X.X.2    Ni, X.G.3
  • 11
    • 70350351543 scopus 로고    scopus 로고
    • Mechanical Properties and Buckling Behaviors of Condensed Double-Walled Carbon Nanotubes
    • Y. Y. Zhang, C. M. Wang and V. B. C. Tan, “Mechanical Properties and Buckling Behaviors of Condensed Double-Walled Carbon Nanotubes”, J. Nanosci. Nanotechnol. 9(8), 4870–4879 (2009). http://dx.doi.org/10.1166/jnn.2009.1092
    • (2009) J. Nanosci. Nanotechnol. , vol.9 , Issue.8 , pp. 4870-4879
    • Zhang, Y.Y.1    Wang, C.M.2    Tan, V.B.C.3
  • 12
    • 77956268429 scopus 로고    scopus 로고
    • A molecular dynamics investigation of the torsional responses of defective single-walled carbon nanotubes
    • Y. Y. Zhang, C. M. Wang and Y. Xiang, “A molecular dynamics investigation of the torsional responses of defective single-walled carbon nanotubes”, Carbon. 48(14), 4100–4108 (2010). http://dx.doi.org/10.1016/j.carbon.2010.07.018
    • (2010) Carbon. , vol.48 , Issue.14 , pp. 4100-4108
    • Zhang, Y.Y.1    Wang, C.M.2    Xiang, Y.3
  • 13
    • 84859451602 scopus 로고    scopus 로고
    • Mechanical property evaluation of single-walled carbon nanotubes by finite element modeling
    • X. X. Lu and Z. Hu, “Mechanical property evaluation of single-walled carbon nanotubes by finite element modeling”, Composites Part B-Engineering. 43(4), 1902–1913 (2012). http://dx.doi.org/10.1016/j.compositesb.2012.02.002
    • (2012) Composites Part B-Engineering. , vol.43 , Issue.4 , pp. 1902-1913
    • Lu, X.X.1    Hu, Z.2
  • 14
    • 84885966799 scopus 로고    scopus 로고
    • Induced anisotropy of chiral carbon nanotubes under combined tension-twisting
    • B. Faria, N. Silvestre and J. N. C. Lopes, “Induced anisotropy of chiral carbon nanotubes under combined tension-twisting”, Mech. Mater. 58, 97–109 (2013). http://dx.doi.org/10.1016/j.mechmat.2012.11.004
    • (2013) Mech. Mater. , vol.58 , pp. 97-109
    • Faria, B.1    Silvestre, N.2    Lopes, J.N.C.3
  • 15
    • 34247882756 scopus 로고    scopus 로고
    • Elastic torsional responses of carbon nanotube systems
    • B. W. Jeong, J. K. Lim and S. B. Sinnott, “Elastic torsional responses of carbon nanotube systems”, J. Appl. Phys. 101(8), 084309 (2007). http://dx.doi.org/10.1063/1.2717138
    • (2007) J. Appl. Phys. , vol.101 , Issue.8 , pp. 084309
    • Jeong, B.W.1    Lim, J.K.2    Sinnott, S.B.3
  • 16
    • 84859742734 scopus 로고    scopus 로고
    • Torsional stability of carbon nanotubes filled with copper atoms
    • L. Wang, Z. Q. Zhang, Y. G. Zheng, J. B. Wang and H. F. Ye, “Torsional stability of carbon nanotubes filled with copper atoms”, Phys. Scripta. 85(4), 045602 (2012). http://dx.doi.org/10.1088/0031-8949/85/04/045602
    • (2012) Phys. Scripta. , vol.85 , Issue.4 , pp. 045602
    • Wang, L.1    Zhang, Z.Q.2    Zheng, Y.G.3    Wang, J.B.4    Ye, H.F.5
  • 17
    • 38849139828 scopus 로고    scopus 로고
    • Molecular dynamics simulations of the torsional instability of carbon nanotubes filled with hydrogen or silicon atoms
    • Q. Wang, K. M. Liew and V. K. Varadan, “Molecular dynamics simulations of the torsional instability of carbon nanotubes filled with hydrogen or silicon atoms”, Appl. Phys. Lett. 92(4), 043120 (2008). http://dx.doi.org/10.1063/1.2840165
    • (2008) Appl. Phys. Lett. , vol.92 , Issue.4 , pp. 043120
    • Wang, Q.1    Liew, K.M.2    Varadan, V.K.3
  • 18
    • 0002467378 scopus 로고
    • Fast Parallel Algorithms for Short-Range Molecular Dynamics
    • S. Plimpton, “Fast Parallel Algorithms for Short-Range Molecular Dynamics”, J. Comput. Phys. 117(1), 1–19 (1995). http://dx.doi.org/10.1006/jcph.1995.1039
    • (1995) J. Comput. Phys. , vol.117 , Issue.1 , pp. 1-19
    • Plimpton, S.1
  • 19
    • 0001256721 scopus 로고    scopus 로고
    • A reactive potential for hydrocarbons with intermolecular interactions
    • S. J. Stuart, A. B. Tutein and J. A. Harrison, “A reactive potential for hydrocarbons with intermolecular interactions”, J. Chem. Phys. 112(14), 6472–6486 (2000). http://dx.doi.org/10.1063/1.481208
    • (2000) J. Chem. Phys. , vol.112 , Issue.14 , pp. 6472-6486
    • Stuart, S.J.1    Tutein, A.B.2    Harrison, J.A.3
  • 20
    • 67649194475 scopus 로고    scopus 로고
    • Buckling of carbon nanotubes at high temperatures
    • Y. Y. Zhang, C. M. Wang and V. B. C. Tan, “Buckling of carbon nanotubes at high temperatures”, Nanotechnology. 20(21), 215702 (2009). http://dx.doi.org/10.1088/0957-4484/20/21/215702
    • (2009) Nanotechnology. , vol.20 , Issue.21 , pp. 215702
    • Zhang, Y.Y.1    Wang, C.M.2    Tan, V.B.C.3
  • 21
    • 84865439078 scopus 로고    scopus 로고
    • Nanomechanics of free form and water submerged single layer graphene sheet under axial tension by using molecular dynamics simulation
    • C. H. Wong and V. Vijayaraghavan, “Nanomechanics of free form and water submerged single layer graphene sheet under axial tension by using molecular dynamics simulation”, Mater. Sci. Eng. A 556, 420–428 (2012). http://dx.doi.org/10.1016/j.msea.2012.07.008
    • (2012) Mater. Sci. Eng. A , vol.556 , pp. 420-428
    • Wong, C.H.1    Vijayaraghavan, V.2
  • 22
    • 84864933614 scopus 로고    scopus 로고
    • Nanomechanics of Nonideal Single- and Double-Walled Carbon Nanotubes
    • C. H. Wong and V. Vijayaraghavan, “Nanomechanics of Nonideal Single- and Double-Walled Carbon Nanotubes”, J. Nanomater. 2012, 17 (2012). http://dx.doi.org/10.1155/2012/490872
    • (2012) J. Nanomater. , vol.2012 , pp. 17
    • Wong, C.H.1    Vijayaraghavan, V.2
  • 23
    • 0037017208 scopus 로고    scopus 로고
    • A second-generation reactive empirical bond order (REBO) potential energy expression for hydrocarbons
    • D.W. Brenner, O. A. Shenderova, J. A. Harrison, S. J. Stuart, B. Ni and S. B. Sinnott, “A second-generation reactive empirical bond order (REBO) potential energy expression for hydrocarbons”, J. Phys.-Conden. Matt. 14(4), 783–802 (2002). http://dx.doi.org/10.1088/0953-8984/14/4/312
    • (2002) J. Phys.-Conden. Matt. , vol.14 , Issue.4 , pp. 783-802
    • Brenner, D.W.1    Shenderova, O.A.2    Harrison, J.A.3    Stuart, S.J.4    Ni, B.5    Sinnott, S.B.6
  • 24
    • 84856599238 scopus 로고    scopus 로고
    • Structure of water confined inside carbon nanotubes and water models
    • Y. Nakamura and T. Ohno, “Structure of water confined inside carbon nanotubes and water models”, Mater. Chem. Phys. 132(2–3), 682–687 (2012). http://dx.doi.org/10.1016/j.matchemphys.2011.11.086
    • (2012) Mater. Chem. Phys. , vol.132 , Issue.2-3 , pp. 682-687
    • Nakamura, Y.1    Ohno, T.2
  • 25
    • 84892562514 scopus 로고    scopus 로고
    • Compressive characteristics of single walled carbon nanotube with water interactions investigated by using molecular dynamics simulation
    • C. H. Wong and V. Vijayaraghavan, “Compressive characteristics of single walled carbon nanotube with water interactions investigated by using molecular dynamics simulation”, Phys. Lett., Sect. A 378(5), 570–576 (2014). http://dx.doi.org/10.1016/j.physleta.2013.12.026
    • (2014) Phys. Lett., Sect. A , vol.378 , Issue.5 , pp. 570-576
    • Wong, C.H.1    Vijayaraghavan, V.2
  • 26
    • 0037434746 scopus 로고    scopus 로고
    • On the water-carbon interaction for use in molecular dynamics simulations of graphite and carbon nanotubes
    • T. Werder, J. H. Walther, R. L. Jaffe, T. Halicioglu and P. Koumoutsakos, “On the water-carbon interaction for use in molecular dynamics simulations of graphite and carbon nanotubes”, J. Phys. Chem. B 107(6), 1345–1352 (2003). http://dx.doi.org/10.1021/jp0268112
    • (2003) J. Phys. Chem. B , vol.107 , Issue.6 , pp. 1345-1352
    • Werder, T.1    Walther, J.H.2    Jaffe, R.L.3    Halicioglu, T.4    Koumoutsakos, P.5
  • 27
    • 0033416612 scopus 로고    scopus 로고
    • Scattering of water from graphite: simulations and experiments
    • N. Marković P. U. Andersson, M. B. Någård and J. B. C. Pettersson, “Scattering of water from graphite: simulations and experiments”, Chem. Phys. 247(3), 413–430 (1999). http://dx.doi.org/10.1016/S0301-0104(99)00233-5
    • (1999) Chem. Phys. , vol.247 , Issue.3 , pp. 413-430
    • Marković, N.1    Andersson, P.U.2    Någård, M.B.3    Pettersson, J.B.C.4
  • 28
    • 35748959008 scopus 로고    scopus 로고
    • An improved fully flexible fixed-point charges model for water from ambient to supercritical condition
    • X. B. Zhang, Q. L. Liu and A. M. Zhu, “An improved fully flexible fixed-point charges model for water from ambient to supercritical condition”, Fluid Phase Equilibria. 262(1-2), 210–216 (2007). http://dx.doi.org/10.1016/j.fluid.2007.09.005
    • (2007) Fluid Phase Equilibria. , vol.262 , Issue.1-2 , pp. 210-216
    • Zhang, X.B.1    Liu, Q.L.2    Zhu, A.M.3
  • 29
    • 77955270721 scopus 로고    scopus 로고
    • Elastic properties of imperfect single-walled carbon nanotubes under axial tension
    • C. H. Wong, “Elastic properties of imperfect single-walled carbon nanotubes under axial tension”, Comput. Mater. Sci. 49(1), 143–147 (2010). http://dx.doi.org/10.1016/j.commatsci.2010.04.037
    • (2010) Comput. Mater. Sci. , vol.49 , Issue.1 , pp. 143-147
    • Wong, C.H.1
  • 30
    • 84881185125 scopus 로고    scopus 로고
    • Nanomechanics of single walled carbon nanotube with water interactions under axial tension by using molecular dynamics simulation
    • V. Vijayaraghavan and C. H. Wong, “Nanomechanics of single walled carbon nanotube with water interactions under axial tension by using molecular dynamics simulation”, Comput. Mater. Sci. 79, 519–526 (2013). http://dx.doi.org/10.1155/2012/490872
    • (2013) Comput. Mater. Sci. , vol.79 , pp. 519-526
    • Vijayaraghavan, V.1    Wong, C.H.2
  • 31
    • 0001538909 scopus 로고
    • Canonical dynamics — equilibrium phase-space distributions
    • W. G. Hoover, “Canonical dynamics — equilibrium phase-space distributions”, Phys. Rev. A 31 (3), 1695–1697 (1985). http://dx.doi.org/10.1103/PhysRevA.31.1695
    • (1985) Phys. Rev. A , vol.31 , Issue.3 , pp. 1695-1697
    • Hoover, W.G.1
  • 32
    • 34547809547 scopus 로고
    • A unified formulation of the constant temperature molecular-dynamics methods
    • S. Nose, “A unified formulation of the constant temperature molecular-dynamics methods”, J. Chem. Phys 81 (1), 511–519 (1984). http://dx.doi.org/http://dx.doi.org/10.1063/1.447334
    • (1984) J. Chem. Phys , vol.81 , Issue.1 , pp. 511-519
    • Nose, S.1
  • 33
    • 22944467757 scopus 로고
    • Computer ‘Experiments’ on Classical Fluids. I. Thermodynamical Properties of Lennard-Jones Molecules
    • L. Verlet, “Computer ‘Experiments’ on Classical Fluids. I. Thermodynamical Properties of Lennard-Jones Molecules”, Phys. Rev 159(1), 98–103 (1967). http://dx.doi.org/10.1103/PhysRev.159.98
    • (1967) Phys. Rev , vol.159 , Issue.1 , pp. 98-103
    • Verlet, L.1
  • 34
    • 77952719236 scopus 로고    scopus 로고
    • Water Transport through Ultrathin Graphene
    • M. E. Suk and N. R. Aluru, “Water Transport through Ultrathin Graphene”, J. Phys. Chem. Lett. 1(10), 1590–1594 (2010). http://dx.doi.org/10.1021/jz100240r
    • (2010) J. Phys. Chem. Lett. , vol.1 , Issue.10 , pp. 1590-1594
    • Suk, M.E.1    Aluru, N.R.2
  • 35
    • 84876138359 scopus 로고    scopus 로고
    • Photoluminescence Measurements and Molecular Dynamics Simulations of Water Adsorption on the Hydrophobic Surface of a Carbon Nanotube in Water Vapor
    • Y. Homma, S. Chiashi, T. Yamamoto, K. Kono, D. Matsumoto, J. Shitaba and S. Sato, “Photoluminescence Measurements and Molecular Dynamics Simulations of Water Adsorption on the Hydrophobic Surface of a Carbon Nanotube in Water Vapor”, Phys. Rev. Lett. 110(15), 157402 (2013). http://dx.doi.org/10.1103/PhysRevLett.110.157402
    • (2013) Phys. Rev. Lett. , vol.110 , Issue.15 , pp. 157402
    • Homma, Y.1    Chiashi, S.2    Yamamoto, T.3    Kono, K.4    Matsumoto, D.5    Shitaba, J.6    Sato, S.7
  • 36
    • 84874677460 scopus 로고    scopus 로고
    • Temperature, defect and size effect on the elastic properties of imperfectly straight carbon nanotubes by using molecular dynamics simulation
    • V. Vijayaraghavan and C. H. Wong, “Temperature, defect and size effect on the elastic properties of imperfectly straight carbon nanotubes by using molecular dynamics simulation”, Comput. Mater. Sci. 71, 184–191 (2013).
    • (2013) Comput. Mater. Sci. , vol.71 , pp. 184-191
    • Vijayaraghavan, V.1    Wong, C.H.2
  • 37
    • 78651345172 scopus 로고    scopus 로고
    • Mechanical properties of graphene under shear deformation
    • K. Min and N. R. Aluru, “Mechanical properties of graphene under shear deformation”, Appl. Phys. Lett. 98 (1), 013113 (2011). http://dx.doi.org/10.1063/1.3534787
    • (2011) Appl. Phys. Lett. , vol.98 , Issue.1 , pp. 013113
    • Min, K.1    Aluru, N.R.2
  • 38
    • 2342460373 scopus 로고    scopus 로고
    • On the study of elastic and plastic properties of multi-walled carbon nanotubes under axial tension using molecular dynamics simulation
    • K. M. Liew, X. Q. He and C. H. Wong, “On the study of elastic and plastic properties of multi-walled carbon nanotubes under axial tension using molecular dynamics simulation”, Acta Mater. 52(9), 2521–2527 (2004). http://dx.doi.org/10.1016/j.actamat.2004.01.043
    • (2004) Acta Mater. , vol.52 , Issue.9 , pp. 2521-2527
    • Liew, K.M.1    He, X.Q.2    Wong, C.H.3
  • 39
    • 31444438273 scopus 로고    scopus 로고
    • Analysis of localized failure of single-wall carbon nanotubes
    • H. Lu and L. Zhang, “Analysis of localized failure of single-wall carbon nanotubes”, Comput. Mater. Sci. 35(4), 432–441 (2006). http://dx.doi.org/10.1016/j.commatsci.2005.02.011
    • (2006) Comput. Mater. Sci. , vol.35 , Issue.4 , pp. 432-441
    • Lu, H.1    Zhang, L.2


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