References
- H. Gleiter, Nanostructured materials: basic concepts and microstructure, Acta Mater. 48 (1) (2000) 1-29. https://doi.org/10.1016/S1359-6454(99)00285-2
- B. Glavin, Low-temperature heat transfer in nanowires, Phys. Rev. Lett. 86 (19) (2001) 4318. https://doi.org/10.1103/PhysRevLett.86.4318
- W. Zhou, Y. Zhang, X. Niu, G. Min, One-dimensional SiC nanostructures: synthesis and properties, One-dimensional Nanostructures, Springer, 2008, pp. 17-59.
- J. Wang, A. Kulkarni, F. Ke, Y. Bai, M. Zhou, Novel mechanical behavior of ZnO nanorods, Comput. Meth. Appl. Mech. Eng. 197 (41-42) (2008) 3182-3189. https://doi.org/10.1016/j.cma.2007.10.011
-
S. Xuan, F. Wang, J.M. Lai, K.W. Sham, Y.-X.J. Wang, S.-F. Lee, J.C. Yu, C.H. Cheng, K.C.-F. Leung, Synthesis of biocompatible, mesoporous
$Fe_3O_4$ nano/microspheres with large surface area for magnetic resonance imaging and therapeutic applications, ACS Appl. Mater. Interfaces 3 (2) (2011) 237-244. https://doi.org/10.1021/am1012358 -
Y. Zhan, R. Zhao, Y. Lei, F. Meng, J. Zhong, X. Liu, A novel carbon nanotubes
$Fe_3O_4$ inorganic hybrid material: synthesis, characterization and microwave electromagnetic properties, J. Magn. Magn. Mater. 323 (7) (2011) 1006-1010. https://doi.org/10.1016/j.jmmm.2010.12.005 -
Y. Zhu, Y. Fang, S. Kaskel, Folate-conjugated
$Fe_3O_4$ $@SiO_2$ hollow mesoporous spheres for targeted anticancer drug delivery, J. Phys. Chem. C 114 (39) (2010) 16382-16388. https://doi.org/10.1021/jp106685q - A.-H. Lu, W. Schmidt, N. Matoussevitch, H. Bonnemann, B. Spliethoff, B. Tesche, E. Bill, W. Kiefer, F. Schuth, Nanoengineering of a magnetically separable hydrogenation catalyst, Angew. Chem. Int. Ed. 116 (33) (2004) 4403-4406. https://doi.org/10.1002/ange.200454222
-
Q. Cheng, F. Qu, N.B. Li, H.Q. Luo, Mixed hemimicelles solid-phase extraction of chlorophenols in environmental water samples with 1-hexadecyl-3-methylimidazolium bromide-coated
$Fe_3O_4$ magnetic nanoparticles with high-performance liquid chromatographic analysis, Anal. Chim. Acta 715 (2012) 113-119. https://doi.org/10.1016/j.aca.2011.12.004 - A. Sundaresan, C. Rao, Ferromagnetism as a universal feature of inorganic nanoparticles, Nano Today 4 (1) (2009) 96-106. https://doi.org/10.1016/j.nantod.2008.10.002
- Q.A. Pankhurst, J. Connolly, S. Jones, J. Dobson, Applications of magnetic nanoparticles in biomedicine, J. Phys. D 36 (13) (2003) R167. https://doi.org/10.1088/0022-3727/36/13/201
-
J. Tucek, L. Machal, S. Ono, A. Namai, M. Yoshikiyo, K. Imoto, H. Tokoro, S.-i. Ohkoshi, R. Zbori,
${\zeta}$ -$Fe_2O_3$ a new stable polymorph in iron(iii) oxide family, Sci. Rep. 5 (2015) 15091. https://doi.org/10.1038/srep15091 -
C. Wu, P. Yin, X. Zhu, C. OuYang, Y. Xie, Synthesis of hematite (
${\alpha}$ -$Fe_2O_3$ ) nanorods: diameter-size and shape effects on their applications in magnetism, lithium ion battery, and gas sensors, J. Phys. Chem. B 110 (36) (2006) 17806-17812. https://doi.org/10.1021/jp0633906 -
K. Sivula, F. Le Formal, M. Gratzel, Solar water splitting: progress using hematite (
${\alpha}$ -$Fe_2O_3$ ) photoelectrodes, ChemSusChem 4 (4) (2011) 432-449. https://doi.org/10.1002/cssc.201000416 - Q.L. Li, Y.F. Wang, C.R. Zhang, Chemical precipitation synthesis and magnetic properties of hematite nanorods, Defect and Diffusion Forum, vol. 293, Trans Tech Publ, 2009, pp. 77-82.
- A.K. Gupta, M. Gupta, Synthesis and surface engineering of iron oxide nanoparticles for biomedical applications, Biomaterials 26b (2005) 3995-4021.
- A.-H. Lu, E. e. Salabas, F. Schuth, Magnetic nanoparticles: synthesis, protection, functionalization, and application, Angew. Chem. Int. 46 (8) (2007) 1222-1244. https://doi.org/10.1002/anie.200602866
-
J.-L. Rehspringer, S. Vilminot, D. Niznansky, K. Zaveta, C. Estournes, M. Kurmoo, A temperature and magnetic field dependence mössbauer study of
${\varepsilon}$ -$Fe_3O_4$ , ICAME 2005, Springer, 2006, pp. 475-481. -
J. Jin, K. Hashimoto, S.-i. Ohkoshi, Formation of spherical and rod-shaped
${\varepsilon}$ -$Fe_3O_4$ nanocrystals with a large coercive field, J. Mater. Chem. 15 (10) (2005) 1067-1071. https://doi.org/10.1039/B416554C -
S.-i. Ohkoshi, S. Sakurai, J. Jin, K. Hashimoto, The addition effects of alkaline earth ions in the chemical synthesis of
${\varepsilon}$ -$Fe_3O_4$ nanocrystals that exhibit a huge coercive field, J. Appl. Phys. 97 (10) (2005) 10K312. https://doi.org/10.1063/1.1855615 -
M. Bonnevie-Svendsen,
${\beta}$ -$Fe_2O_3$ eine neue eisen(iii)oxyd-struktur, Die Naturwissenschaften 45 (22) (1958) 542. -
L. Ben-Dor, E. Fischbein, Z. Kalman, Concerning the
${\beta}$ phase of iron (iii) oxide, Acta Crystallogr. B Struct. Cryst. Cryst. Chem. 32 (2) (1976) 667-667. https://doi.org/10.1107/S0567740876003749 -
L. Ben-Dor, E. Fischbein, I. Felner, Z. Kalman,
${\beta}$ -$Fe_2O_3$ : preparation of thin films by chemical vapor deposition from organometallic chelates and their characterization, J. Electrochem. Soc. 124 (3) (1977) 451-457. https://doi.org/10.1149/1.2133323 -
M. Ikeda, Y. Takano, Y. Bando, Formation mechanism of needle-like
${\alpha}$ -$Fe_2O_3$ particles grown along the c axis and characterization of precursorily formed${\beta}$ -$Fe_2O_3$ , Bull. Inst. Chem. Res. Kyoto Univ. 64 (4) (1986) 249-258. -
C.-W. Lee, S.-S. Jung, J.-S. Lee, Phase transformation of
${\beta}$ -$Fe_2O_3$ hollow nanoparticles, Mater. Lett. 62 (4-5) (2008) 561-563. https://doi.org/10.1016/j.matlet.2007.08.073 -
P. Brazda, J. Kohout, P. Bezdicka, T. Kmjec,
${\alpha}$ -$Fe_2O_3$ versus${\beta}$ -$Fe_2O_3$ : controlling the phase of the transformation product of${\varepsilon}$ -$Fe_2O_3$ in the$Fe_2O_3$ /$SiO_2$ system, Cryst. Growth Des. 14 (3) (2014) 1039-1046. https://doi.org/10.1021/cg4015114 - R. Zboril, M. Mashlan, D. Petridis, Iron (iii) oxides from thermal processes synthesis, structural and magnetic properties, mossbauer spectroscopy characterization, and applications, Chem. Mater. 14 (3) (2002) 969-982. https://doi.org/10.1021/cm0111074
-
T. Gonzalez-Carreno, M.P. Morales, C. Serna, Fine
${\beta}$ -$Fe_2O_3$ particles with cubic structure obtained by spray pyrolysis, J. Mater. Sci. Lett. 13 (1994) 381-382. https://doi.org/10.1007/BF00420805 - N. Jones, B. Reddy, F. Rasouli, S.N. Khanna, Structural growth in iron oxide clusters: rings, towers, and hollow drums, Phys. Rev. B 72 (16) (2005) 165411. https://doi.org/10.1103/PhysRevB.72.165411
- S. Lopez, A.H. Romero, J. Mejia-Lopez, J. Mazo-Zuluaga, J. Restrepo, Structure and electronic properties of iron oxide clusters: a first-principles study, Phys. Rev. B 80 (8) (2009) 085107. https://doi.org/10.1103/PhysRevB.80.085107
-
V. Tomar, M. Zhou, Analyses of tensile deformation of nanocrystalline
${\alpha}$ -$Fe_2O_3+$ fcc-al composites using molecular dynamics simulations, J. Mech. Phys. Solid. 55 (5) (2007) 1053-1085. https://doi.org/10.1016/j.jmps.2006.10.005 -
D. Cooke, S. Redfern, S. Parker, Atomistic simulation of the structure and segregation to the (0001) and surfaces of
$Fe_2O_3$ , Phys. Chem. Miner. 31 (8) (2004) 507-517. https://doi.org/10.1007/s00269-004-0396-9 -
D. Chicot, J. Mendoza, A. Zaoui, G. Louis, V. Lepingle, F. Roudet, J. Lesage, Mechanical properties of magnetite (
$Fe_3O_4$ ), hematite (${\alpha}$ -$Fe_2O_3$ ) and goethite (${\alpha}$ -FeO oh) by instrumented indentation and molecular dynamics analysis, Mater. Chem. Phys. 129 (3) (2011) 862-870. https://doi.org/10.1016/j.matchemphys.2011.05.056 - J. Mohapatra, A. Mitra, H. Tyagi, D. Bahadur, M. Aslam, Iron oxide nanorods as high-performance magnetic resonance imaging contrast agents, Nanoscale 7 (20) (2015) 9174-9184. https://doi.org/10.1039/C5NR00055F
-
S. Alaei, S. Erkoc, Structural properties of
${\beta}$ -$Fe_2O_3$ nanorods under strain: molecular dynamics simulations, J. Comput. Theor. Nanosci. 11 (1) (2014) 242-248. https://doi.org/10.1166/jctn.2014.3344 - G. Rubio-Bollinger, S.R. Bahn, N. Agrat, K.W. Jacobsen, S. Vieira, Mechanical properties and formation mechanisms of a wire of single gold atoms, Phys. Rev. Lett. 87 (2001) 026101. https://doi.org/10.1103/PhysRevLett.87.026101
- K.J.W, H.H. wang, Pentagonal multi-shell Cu nanowire, J. Phys. Condens. Matter. 14 (2002) 2629.
- H.Y. Zhang, X. Gu, X. Zhang, Y.X, X. Gong, Structures and properties of Ni nanowires, Phys. Lett. A 331 (2004) 332-336. https://doi.org/10.1016/j.physleta.2004.08.016
- S. Koh, H. Lee, C. Lu, Q. Cheng, Molecular dynamics simulation of a solid platinum nanowire under uniaxial tensile strain: temperature and strain-rate effects, Phys. Rev. B 72 (8) (2005) 085414. https://doi.org/10.1103/PhysRevB.72.085414
- M.E. Kilic, S. Erkoc, Structural properties of defected ZnO nanoribbons under uniaxial strain: molecular dynamics simulations, Curr. Appl. Phys. 14 (1) (2014) 57-67. https://doi.org/10.1016/j.cap.2013.10.009
- S. Erkoc, Molecular Dynamics Program for Cluster Simulations (md-tpc-pbc.F), METU, TR, 2010.
- J.D. Gale, A.L. Rohl, The general utility lattice program (gulp), Mol. Simulat. 29 (5) (2003) 291-341. https://doi.org/10.1080/0892702031000104887
- A. Pedone, G. Malavasi, M.C. Menziani, A.N. Cormack, U. Segre, A new self-consistent empirical interatomic potential model for oxides, silicates, and silica-based glasses, J. Phys. Chem. B 110 (24) (2006) 11780-11795. https://doi.org/10.1021/jp0611018
- M.E. Kilic, S. Erkoc, Structural properties of ZnO nanotubes under uniaxial strain: molecular dynamics simulations, J. Nanosci. Nanotechnol. 13 (10) (2013) 6597-6610. https://doi.org/10.1166/jnn.2013.7207
- A. Rimola, D. Costa, M. Sodupe, J.-F. Lambert, P. Ugliengo, Silica surface features and their role in the adsorption of biomolecules: computational modeling and experiments, Chem. Rev. 113 (6) (2013) 4216-4313. https://doi.org/10.1021/cr3003054
-
V. Metlenko, A.H. Ramadan, F. Gunkel, H. Du, H. Schraknepper, S. Hoffmann- Eifert, R. Dittmann, R. Waser, R.A. De Souza, Do dislocations act as atomic autobahns for oxygen in the perovskite oxide
$SrTiO_3$ Nanoscale 6 (21) (2014) 12864-12876. https://doi.org/10.1039/C4NR04083J - J.M. Haile, Molecular Dynamics Simulation: Elementary Methods vol. 1, Wiley, New York, 1992.
- S. Nose, A molecular dynamics method for simulations in the canonical ensemble, Mol. Phys. 52 (2) (1984) 255-268. https://doi.org/10.1080/00268978400101201
- W.G. Hoover, Canonical dynamics: equilibrium phase-space distributions, Phys. Rev. A 31 (3) (1985) 1695. https://doi.org/10.1103/PhysRevA.31.1695
-
S. Le Roux, P. Jund, Ring statistics analysis of topological networks: new approach and application to amorphous
$GeS_2$ and$SiO_2$ systems, Comput. Mater. Sci. 49 (2010) 70-83, https://doi.org/10.1016/j.commatsci.2010.04.023. -
S. Le Roux, P. Jund, Erratum: ring statistics analysis of topological networks: new approach and application to amorphous
$GeS_2$ and$SiO_2$ systems, Comput. Mater. Sci. 49 (2010) 70-83, https://doi.org/10.1016/j.commatsci.2010.04.023. - A. Otero-de-la Roza, V. Luana, Gibbs2: a new version of the quasi-harmonic model code. i. robust treatment of the static data, Comput. Phys. Commun. 182 (2011) 1708-1720, https://doi.org/10.1016/j.cpc.2011.04.016.
Cited by
- Formation of Interstitial Dislocation Loops by Irradiation in Alpha-Iron under Strain: A Molecular Dynamics Study vol.11, pp.3, 2018, https://doi.org/10.3390/cryst11030317