Article

Two-dimensional waves in extended square lattice

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Abstract

We consider a two-dimensional square lattice model extended by additional not closed neighboring interactions. We assume the elastic forces between the masses in the lattice to be nonlinearly dependent on the spring elongations. First, we use an analysis of the linearized discrete equations to reveal the influence of additional interactions on the properties of the dispersion relation for longitudinal and shear plane waves. Then we develop an asymptotic procedure to obtain continuum two-dimensional non-linear equations to study the transverse instability of weakly non-linear localized plane longitudinal and shear waves. We find that the additional interactions used in the model may affect the sign of the amplitude of the plane strain waves (existence of compression (minus sign) or tensile (plus sign) plane waves) and their transverse stability.

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... A development of this approach is needed in two-dimensional lattice models. Recently various two-dimensional nonlinear lattices were studied in [4,5]. As a rule, an analytical study of the discrete nonlinear problem is impossible, and a continuum limit was applied in [4,5] in order to obtain the governing nonlinear partial differential equations for the strains. ...
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... It was found in [4,5] that longitudinal strains obey the famous Kadomtsev-Petviashvili equation [6] whose solutions including localized ones are well known. An equation with other features has been derived for shear strains. ...
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In the analysis of dynamics of an ideal system as well as a system with point defects, the role of interaction is considered not only for the nearest neighbors. The Green’s function is constructed for steady-state vibrations of a chain at all possible frequencies. It is shown that, if the interaction with the next-to-nearest neighbors is taken into account, the Green’s function inevitably becomes double partial, the nature of its two components depending significantly on its eigenfrequency. It is found that the Green’s function for frequencies of the continuous spectrum of small vibrations has one component of the plane wave type, while the other component is localized near the source of perturbations. Such a Green’s function describes the so-called quasilocal vibrations. At certain discrete frequencies falling in the continuous spectrum, the quasilocal vibration is transformed into local vibration (that does not propagate to infinity). The conditions of applicability of differential equations with fourth spatial derivative are analyzed for describing the longwave vibrations of the atomic chain. Relations between parameters of atomic interactions permitting the use of such equations are formulated. Asymptotic forms of soliton fields in a nonlinear medium with spatial dispersion are discussed. It is shown that most of the soliton parameters are determined by the dispersion relation for the linearized equation.
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This paper presents a derivation of a second-order isotropic continuum from a 2D lattice. The derived continuum is isotropic and dynamically consistent in the sense that it is unconditionally stable and prohibits the infinite speed of energy propagation. The Lagrangian density of the continuum is obtained from the Lagrange function of the underlying lattice. This density is used to obtain the expressions for standard and higher-order stresses in direct correspondence with the equations of the continuum motion. The derived continuum is characterized by two additional parameters relative to the classical elastic continuum. These are the characteristic lengthscale and a dimensionless continualization parameter, which characterizes indirectly the timescale of the derived continuum. The margins for the latter parameter are found from the stability analysis. It is envisaged that the continualization parameter could be measured employing a high-frequency pulse propagating along the surface of the continuum. Excitation and propagation of such pulse is studied theoretically in this paper.
Book
1. Introduction.- 2. The Binary Collision Model.- 2.1 Laboratory System.- 2.2 Centre-of-Mass System.- 2.3 Relations Between Laboratory and Centre-of-Mass Systems.- 2.4 Energy Transfer.- 2.5 Classical Scattering Theory.- 2.6 Asymptotic Trajectories.- 2.7 Determination of the Scattering Angle and the Time Integral.- 2.8 Limitations of the Binary Collision Approximation.- 2.9 Limitations of the Classical Mechanics Treatment.- 3. Classical Dynamics Model.- 3.1 Newton's Equations.- 3.2 Integration of Newton's Equations.- 3.2.1 Central Difference Scheme.- 3.2.2 Average Force Method.- 3.2.3 Euler-Cauchy Scheme.- 3.2.4 Predictor-Corrector Scheme.- 3.2.5 The Verlet Scheme.- 3.2.6 Nordsieck Method.- 3.3 The Time Step, Bookkeeping.- 4. Interaction Potentials.- 4.1 Screened Coulomb Potentials.- 4.2 The Born-Mayer Potential.- 4.3 Attractive Potentials.- 4.4 Combined Potentials.- 4.5 Empirical Potentials.- 4.6 Embedded Atom Method.- 4.7 Analytical Methods.- 4.8 Comparison of Potentials.- 5. Inelastic Energy Loss.- 5.1 Local Electronic Energy Loss.- 5.2 Continuous Electronic Energy Loss.- 5.3 Comparison.- 6. Thermal Vibrations and Specific Energies.- 6.1 Thermal Vibrations.- 6.2 Specific Energies.- 6.2.1 Cutoff Energy.- 6.2.2 Displacement Energy.- 6.2.3 Bulk Binding Energy.- 6.2.4 Surface Binding Energy.- 7. Programs Based on the BCA Model.- 7.1 Random Target Structures.- 7.2 Monte Carlo Programs.- 7.3 Crystalline Targets.- 7.4 Lattice Programs.- 7.5 TRIM.SP and TRIDYN.- 7.5.1 TRIM.SP.- 7.5.2 TRIDYN.- 7.6 MARLOWE.- 8. Programs Based on the Classical Dynamics Model.- 8.1 Stable, Metastable and Quasi-Stable Programs.- 8.2 Classical Dynamics Programs.- 9. Trajectories.- 10. Ranges.- 10.1 Definitions.- 10.2 Literature.- 10.3 Examples.- 11. Backscattering.- 11.1 Definitions.- 11.2 Literature.- 11.3 Examples.- 12. Sputtering.- 12.1 Definitions.- 12.2 Negative Binomial Distribution.- 12.3 Literature.- 12.4 Examples.- 13. Radiation Damage.- 13.1 Definitions.- 13.2 Component Analysis.- 13.3 Fuzzy Clustering.- 13.4 Literature.- 13.5 Examples.- Abbreviations Used in the Tables.- Constants.- References.- Author Index.
Article
The results of numerical simulations are presented for propagation of solitary waves along an auxetic infinite plate. An analysis of amplitudes and velocities of the waves is described for various initial pulses for both common and auxetic materials.
Article
Elastic properties of a rotator phase of hard homonuclear dumbbells are determined by constant pressure Monte Carlo simulations. Simple approximations expressing the influence of molecular anisotropy on the elastic constants and Poisson’s ratio are found. The maximum density at which the dumbbells with their mass centers fixed at the lattice sites can freely rotate is observed to be strongly correlated with the density at which C12=C44. It is also shown that Poisson’s ratio measured along any direction and averaged with respect to directions transverse to it is always positive. At any fixed pressure, the averaged Poisson ratio increases with increasing dumbbell anisotropy.
Article
Poisson's ratio is, for specified directions, the ratio of a lateral contraction to the longitudinal extension during the stretching of a material. Although a negative Poisson's ratio (that is, a lateral extension in response to stretching) is not forbidden by thermodynamics, this property is generally believed to be rare in crystalline solids. In contrast to this belief, 69% of the cubic elemental metals have a negative Poisson's ratio when stretched along the [110] direction. For these metals, we find that correlations exist between the work function and the external values of Poisson's ratio for this stretch direction, which we explain using a simple electron-gas model. Moreover, these negative Poisson's ratios permit the existence, in the orthogonal lateral direction, of positive Poisson's ratios up to the stability limit of 2 for cubic crystals. Such metals having negative Poisson's ratios may find application as electrodes that amplify the response of piezo-electric sensors.
Article
The directional behaviour of Young's modulus, shear modulus, and Poisson's ratio are expressed for a number of crystallographic planes for cubic materials. Their behaviour as a function of direction on a particular plane is shown to be a simple sum of sines and cosines of twice and sometimes of four times the angle. A general expression gives the coefficients for the sines and cosines and a table gives the coefficients for 19 planes on the standard triangle of the stereographic projection. Superposed on the stereographic projection are shown polar plots of the shear modulus Gprime12 (1prime direction normal to the plane) for silicon. Examples are also given showing G12prime for copper for some planes of zones [1bar above 00], [1bar above 10] and [2bar above 10].
Article
The global maximum and global minimum Poisson's ratio (PR) surfaces, regions of different auxetic behaviour and the domains of the different extreme directions of cubic materials are shown and discussed in terms of the elastic moduli ratios, , where K is the bulk modulus and are shear moduli. A straightforward way is given to classify any cubic material as being auxetic, nonauxetic and partially auxetic, as well as calculating its extreme PR values. A decomposition of the XY plane with the elastic constant ratio is introduced to facilitate the interpretation of cubic materials under hydrostatic pressure, , and isotropic tension, , which are two qualitatively different situations. Using this representation it is demonstrated that cubic materials with can be auxetic only under ‘negative’ pressure (). It is shown that the influence of pressure on the auxetic behaviour is different for the positive and negative cases. In particular, a cubic material with may be auxetic at negative as well as positive pressure. The work demonstrates the crucial role of P in obtaining desired auxetic behaviour. Microscopic mechanisms which tune the cubic system to targeted regions in the XY plane are investigated with a fcc crystal of particles interacting via the pairwise spherically symmetric potential, . It is found that all fcc static models in which the range of interaction is only between nearest neighbour particles are placed on a universal curve in the XY plane. It is shown that auxetic behaviours can be achieved with simple static analytic forms. The influence of the next neighbour interactions on the universal curve is also considered. In order to assess the role of thermal fluctuations, molecular dynamic simulations for two different (the Lennard–Jones (LJ) and the tethered particle potentials) were performed. At low temperatures the studied systems are well represented by the universal curve and on increasing temperature a systematic departure from it is observed.
Article
Nonlinear oscillations of a single particle in the potential well and for one-dimensional chain of interacting particles are considered. The law of interaction is of Lennard-Jones type, mimicking interaction in atomic systems. Similarities in average behaviour of the systems with one and many degrees of freedom are shown. Time averaging for the random oscillations is used to obtain thermodynamic characteristics such as pressure, specific volume, and thermal energy. Second order equation of state is obtained, which is valid in the conditions of strong extension, where fails the widely used Mie–Gr€ u uneisen equation of state.
Article
The dependence of the elastic moduli of a nanocrystal on its size is investigated theoretically with reference to a two-dimensional single-crystal strip. It is shown that the uncertainty (of a fundamental nature) in the size of a nanocrystal causes the determination of many of its mechanical characteristics to be ambiguous. It is found that the Cauchy-Green relations are modified and the elastic-constant tensor ceases to be symmetric; the size and shape of a nanocrystal render its mechanical properties more anisotropic. For a single-crystal strip, the Poisson ratio decreases and the Young modulus increases with decreasing thickness of the strip; in the case of a very thin crystal film (two atomic layers thick), these elastic moduli can differ from their macroscopic values by a factor of two. The size effects which make the continuum elasticity theory inapplicable to nanocrystals are estimated. The size effects that occur when the molecular dynamics method is applied for modeling macroscopic objects are also discussed.
Article
It is shown that generation of the rogue waves in the ocean may be described in framework of non-linear two-dimensional shallow water theory where the simplest two-dimensional long wave non-linear model corresponds to the Kadomtsev–Petviashvili (KP) equation. Numerical solution of the KP equation is obtained to account for the formation of localized abnormally high amplitude wave due to a resonant superposition of two incidentally non-interacting long-crested waves. Peculiarities of the solution allow to explain rare and unexpected appearance of the rogue waves. However, our solution differs from the exact two-solitary wave solution of the KP equation used before for the rogue waves description.
Article
The influence of an external medium on the evolution of two-dimensional long non-linear strain waves in an elastic plate is studied. The governing non-linear equations for longitudinal and shear waves are obtained. A threshold value of the external medium parameter is found that separates the existence of either one-dimensional (or plane) localized strain wave or two-dimensional localized strain wave. A considerable increase in the amplitude of the wave is found during the formation of the two-dimensional localized strain wave from an arbitrary initial pulse.
Article
The second order elastic moduli λ1 ≡ λξηξη and λ2 ≡ λξξηη of a perfect two-dimensional (2D) hard disk crystal are determined by the constant thermodynamic tension Monte Carlo method. The elastic moduli show the free-volume-like density dependence, , where ρ0 is the density at close packing, and prove to be close to those for hexagonal planes of the three-dimensional (3D) fcc and hcp crystals of hard spheres. The Kosterlitz-Thouless, Halperin-Nelson, and Young elastic constant is estimated to approach the universal value 16π in the phase coexistence region of the system.
Article
The paper describes a nonlinear phenomenon of interaction of waves that may be a reason for the existence of high-amplitude wave humps on the sea surface. The properties of extreme elevation area in the vicinity of the intersection point of two long-crested shallow water waves travelling in slightly different directions are evaluated in the framework of two-soliton solution of the Kadomtsev–Petviashvili equation. The extent of the area where surface elevation exceeds a certain level is estimated analytically based on the study of corresponding surface isolines. Shown is that this area is very narrow in the direction of its propagation. The extreme slopes at the front of the interaction soliton may eight times exceed the maximum slope of the interacting solitons.
Article
In this paper, the derivation of higher-order continuum models from a discrete medium is addressed, with the following aims: (i) for a given discrete model and a given coupling of discrete and continuum degrees of freedom, the continuum should be defined uniquely, (ii) the continuum is isotropic, and (iii) boundary conditions are derived consistently with the energy functional and the equations of motion of the continuum. Firstly, a comparison is made between two continualisation methods, namely based on the equations of motion and on the energy functional. They are shown to give identical results. Secondly, the issue of isotropy is addressed. A new approach is developed in which two, rather than one, layers of neighbouring particles are considered. Finally, the formulation and interpretation of boundary conditions is treated. By means of the Hamilton–Ostrogradsky principle, boundary conditions are derived that are consistent with the energy functional and the equations of motion. A relation between standard stresses and higher-order stresses is derived and used to make an interpretation of the higher-order stresses. An additional result of this study is the non-uniqueness of the higher-order contributions to the energy.
Article
Poisson's ratio in materials is governed by the following aspects of the microstructure: the presence of rotational degrees of freedom, non-affine deformation kinematics, or anisotropic structure. Several structural models are examined. The non-affine kinematics are seen to be essential for the production of negative Poisson's ratios for isotropic materials containing central force linkages of positive stiffness. Non-central forces combined with pre-load can also give rise to a negative Poisson's ratio in isotropic materials. A chiral microstructure with non-central force interaction or non-affine deformation can also exhibit a negative Poisson's ratio. Toughness and damage resistance in these materials may be affected by the Poisson's ratio itself, as well as by generalized continuum aspects associated with the microstructure.
Article
Anisotropies of Young's modulus E, the shear modulus G, and Poisson's ratio of all 2D symmetry systems are studied. Simple necessary and sufficient conditions on their elastic compliances are derived to identify if any of these crystals are completely auxetic, non-auxetic and auxetic. Particular attention is paid to 2D crystals of quadratic symmetry. All mechanically stable quadratic crystals are characterized by three parameters belonging to a prism with the stability triangle in the base. Regions in the stability triangle in which quadratic materials are completely auxetic, non-auxetic, and auxetic are established. Examples of all types of auxetic properties of crystals of oblique and rectangular symmetry are presented.
Lattice Dynamical Foundations of Continuum Theories
  • A Askar
A. Askar, Lattice Dynamical Foundations of Continuum Theories, World Scientific, Singapore, 1985.