Effect of certain factors on the vibrations of polymers

The authors' work on the effect of various factors on the vibrations of the polymer chain is reviewed. A method of calculating chain vibrations is briefly described, an expression is given for the strain energy of a polymer molecule in the nonlinear approximation, the frequency shift of the vibrations of a molecule under load is calculated and discussed, the effect of intermolecular interaction in the polymer crystal and the disorder of the chain on the vibration spectrum is taken into account, and the change in the intensity of the normal vibrations when the chain is loaded and the effect of anharmonicity on the band width are investigated. In conclusion, the stress distribution over the interatomic bonds is estimated.A. F. Ioffe Physico-Technical Institute, Academy of Sciences of the USSR, Leningrad. Translated from Mekhanika Polimerov, No. 1, pp. 33–46, January–February, 1975.     

Calculation of damage and of force relaxation in amorpho-crystalline polymers

The dynamics of damage and of the relaxing force in amorpho-crystalline polymers under constant strain are calculated using the formulas for the probability of rupture of a deformed polymer molecule and a model representation of amorphous interlayers. The main parameters of the model are the maximum and minimum possible deformations of molecular chains, the energy of rupture activation, the function of the chain length distribution, the temperature, the macroscopic strain, and the relative dimensions of the amorphous interlayer. The conformity of the theoretical model and the association of the relaxation spectrum with the internal molecular and structural characteristics of the material are established.Zhambyl Technical Institute of Light and Food Industry, Taraz, Kazakhstan. Translated from Mekhanika Kompozitnykh Materialov, Vol. 35, No. 4, pp. 499–508, July–August, 1999.     

A stick-slip/Rouse hybrid model for viscoelasticity in polymers

A Rouse model for polymer chains is incorporated into the linear continuous stick-slip molecular-based tube reptation ideas of Doi–Edwards and Johnson–Stacer. This treats the physically constrained (PC) molecular stretches as internal strain variables for the overall PC/chemically cross-linked (CC) system. It yields an explicit system of stress–strain equations for the system permitting simple calculations of complex stress–strain relations. The model that is developed here treats PC molecule as entrapped within a constraining tube, which is comprised of both CC and PC molecules. The model is compared with experimental data sets from the literature.     

Thermodynamics / turbulence analogy modelling dissipating molecular gas flows for high Knudsen numbers

Modelling micro channel flows momentum and heat diffusion / convection are recent parameters modelling the molecule velocity distribution. Macroscopic models describe velocity and energy / enthalpie with integrals of mass increments. Using microscopic models motion and forces of a molecular flow have to be computed by models of physical properties, whose are described by statistical power moments of the molecule velocity. Therefore dilute flows have to be investigated in small channels with a mean free path length of molecules higher than the channel width of the the micro channel itself (λ₀≥H₀). Modelling this process by a continuous flow the boundary conditions have to be modified (e.g. [6]). The present model uses the statistical approximation of the molecule velocity distribution to simulate the behaviour of this discrete flow with a weighted averaged molecule velocity ∼ξ_i, its standard deviation σ and the characterisic molecule collision rate z. The number density N per volume V near one position is used for the weighting factor averaging method describing the mean molecule velocity. The present model is validated computing Poiseuille and Couette flows with different Knudsen numbers. Showing the advantages of the present model the simulation results are compared with simulation results of the wall–distance depending diffusivity model of Lockerby and Reese [4] and BGK results of a Lattice–Boltzmann simulation. (© 2008 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim)     

On the constitutive relations for isotropic and transversely isotropic materials

In this work the strain and stress spaces constitutive relations for isotropic and transversely isotropic softening materials are developed. The loading surface is considered in the strain space and the normality rule; the stress relaxation is proportional to the gradient of the loading surface, is adopted. It is found that the strain space plasticity theory allows us to describe the hardening, perfectly plastic and softening materials more accurately. The validity of the strain space constitutive relation for transversely isotropic materials are confirmed by comparing with the experimental data for fiber reinforced composite materials. Some numerical examples in two and three dimensional elasto-plastic problems for various loading–unloading conditions are presented, and give a very good agreement with the existing results.     

Implications of Shield’s inverse deformation theorem for compressible finite elasticity

Some properties of the Shield transformation on elastic strain energy functions are established. It is reflexive, it preserves objectivity and material symmetry for isotropic materials, and it also preserves infinitesimal strain response, ellipticity and Hadamard stability, and the Baker–Ericksen condition. Two new classes of strain energies for compressible isotropic materials are introduced, one of them being the image under the Shield transformation of the class of harmonic strain energies. In view of Shield’s Inverse Deformation Theorem, these new classes of strain energies will allow solution in closed form of a variety of problems in finite elastostatics.     

Nonlinear transversely isotropic elastic solids: an alternative representation

A strain energy function which depends on five independent variablesthat have immediate physical interpretation is proposed forfinite strain deformations of transversely isotropic elasticsolids. Three of the five variables (invariants) are the principalstretch ratios and the other two are squares of the dot productbetween the preferred direction and two principal directionsof the right stretch tensor. The set of these five invariantsis a minimal integrity basis. A strain energy function, expressedin terms of these invariants, has a symmetry property similarto that of an isotropic elastic solid written in terms of principalstretches. Ground state and stress–strain relations aregiven. The formulation is applied to several types of deformations,and in these applications, a mathematical simplicity is highlighted.The proposed model is attractive if principal axes techniquesare used in solving boundary-value problems. Experimental advantageis demonstrated by showing that a simple triaxial test can varya single invariant while keeping the remaining invariants fixed.A specific form of strain energy function can be easily obtainedfrom the general form via a triaxial test. Using series expansionsand symmetry, the proposed general strain energy function isrefined to some particular forms. Since the principal stretchesare the invariants of the strain energy function, the Valanis–Landelform can be easily incorporated into the constitutive equation.The sensitivity of response functions to Cauchy stress datais discussed for both isotropic and transversely isotropic materials.Explicit expressions for the weighted Cauchy response functionsare easily obtained since the response function basis is almostmutually orthogonal.     

Implications of Shield’s inverse deformation theorem for compressible finite elasticity

Some properties of the Shield transformation on elastic strain energy functions are established. It is reflexive, it preserves objectivity and material symmetry for isotropic materials, and it also preserves infinitesimal strain response, ellipticity and Hadamard stability, and the Baker–Ericksen condition. Two new classes of strain energies for compressible isotropic materials are introduced, one of them being the image under the Shield transformation of the class of harmonic strain energies. In view of Shield’s Inverse Deformation Theorem, these new classes of strain energies will allow solution in closed form of a variety of problems in finite elastostatics. Received: January 30, 2002     

Superinfection Behaviors on Scale-Free Networks with Competing Strains

This paper considers the epidemiology of two strains (I,J) of a disease spreading through a population represented by a scale-free network. The epidemiological model is SIS and the two strains have different reproductive numbers. Superinfection means that strain I can infect individuals already infected with strain J, replacing the strain J infection. Individuals infected with strain I cannot be infected with strain J. The model is set up as a system of ordering differential equations and stability of the disease free, marginal strain I and strain J, and coexistence equilibria are assessed using linear stability analysis, supported by simulations. The main conclusion is that superinfection, as modeled in this paper, can allow strain I to coexist with strain J even when it has a lower basic reproductive number. Most strikingly, it can allow strain I to persist even when its reproductive number is less than 1.     

The integration of analysis and testing for the simulation of the response of hyperelastic materials

A family of hyperelastic finite elements capable of modeling arbitrarily large strains for axisymmetric and plane strain analyses has been developed. Constitutive behavior is determined by the selection of a strain energy density function for which user-supplied coefficients are required. Selective reduced integration for the volumetric strain energy terms allows for successful modeling of nearly incompressible materials. Available strain energy density functions are as follows: Mooney-Rivlin, Blatz-Ko, power law, and a nine-term Mooney expansion. The Ogden Strain Energy (OSE) law has also been implemented. The OSE law defines the strain energy relationship entirely in terms of the three principal components of stretch. This differs from the approach of other strain energy formulations, such as the Mooney law in which the strain energy is written as a function of strain invariants. The OSE law as implemented in this formulation is designed to facilitate the user's task of converting physical test data to the numerical (algebraic) form required for input. The family of hyperelastic finite elements has been integrated into ANSYS Revision 4.2 via the user element interface. Numerous verification solutions have been performed. As a representative example, a comparison with a closed-form solution for a Mooney-Rivlin type material is presented. Finally, the difficulties of obtaining test data in the form of user-supplied constants is discussed in the context of the comparison of experimental measurements and analytical simulation of an elastomeric test specimen.     

Stability of strain gradient elastic bars in tension

Equilibrium of a bar under uniaxial tension is considered as optimization problem of the total potential energy. Uniaxial deformations are considered for a material with linear constitutive law of strain second gradient elasticity. Applying tension on an elastic bar, necking is shown up in high strains. That means the axial strain forms two homogeneously deformed sections in the ends of the bars and a section in the middle with high variable strain. The interactions of the intrinsic (material) lengths with the non linear strain displacement relations develop critical states of bifurcation with continuous Fourier’s spectrum. Critical conditions and post-critical deformations are defined with the help of multiple scales perturbation method. An erratum to this article can be found at     

Investigation of the integral creep equations (cubic nonlinearity) for different loading paths

Expressions for the creep strain obtained in accordance with the Leaderman-Rozovskii theory and in the form of a multiple-integral Volterra series are compared for different loading paths. The influence functions are assumed to be symmetrical. The strain intensity-time curves are calculated for a complex loading path for which the stress intensity is constant. It is found that these curves are nonmonotonic for both linear and nonlinear creep.Read at Fourth Symposium on Rheology, Moscow, May 27–30, 1969.Institute of Polymer Mechanics, Academy of Sciences of the Latvian SSR, Riga. Translated from Mekhanika Polimerov, No. 1, pp. 35–42, January–February, 1970.     

Nonlinear bending and buckling for strain gradient elastic beams

Nonlinear bending of strain gradient elastic thin beams is studied adopting Bernoulli–Euler principle. Simple nonlinear strain gradient elastic theory with surface energy is employed. In fact linear constitutive relations for strain gradient elastic theory with nonlinear strains are adopted. The governing beam equations with its boundary conditions are derived through a variational method. New terms are considered, already introduced for linear cases, indicating the importance of the cross-section area, in addition to moment of inertia in bending of thin beams. Those terms strongly increase the stiffness of the thin beam. The non-linear theory is applied to buckling problems of thin beams, especially in the study of the postbuckling behaviour.     

Yield surfaces in local strain theory

The initial yield surfaces for biaxial tension and combined tension and torsion are determined on the basis of the local strain theory. The limit surfaces of the resultant stress on a local plane in tension (torsion) are obtained. A plastic strain probability factor is introduced and its values are calculated for various loading paths.Institute of Polymer Mechanics, Academy of Sciences of the Latvian SSR, Riga. Translated from Mekhanika Polimerov, No. 4, pp. 594–598, July–August, 1971.     

Estimation of the macroscopic stress-strain curve of a particulate composite with a crosslinked polymer matrix

The main focus of the present paper is the estimation of the macroscopic stress–strain behavior of a particulate composite. A composite with a cross-linked polymer matrix in a rubbery state filled with an alumina-based mineral filler is investigated by means of the finite-element method. The hyperelastic material behavior of the matrix is described by the Mooney–Rivlin material model. Numerical models on the basis of unit cells are developed. The existence of a discontinuity (breaking) in the matrix at higher loading levels is taken into account to obtain a more accurate estimate for the stress–strain behavior of the particulate composite investigated. The numerical results obtained are compared with an experimental stress–strain curve, and a good agreement is found to exist. The paper can contribute to a better understanding of the behavior and failure of particulate composites with a polymer matrix.     

The relativistic theory of chemical binding

Starting from Breit’s relativistic equation for a system of two electrons, it is shown that for a hydrogen molecule (or for a system of two electrons moving in a field of cylindrical symmetry) the component of the total angular momentum (J _x ) along the axis of the molecule (axis of symmetry) is a constant of motion. Thus every eigenstate of the system is simultaneously an eigenstate of J _x also, and a state of the system will specify, besides its energy, only the eigenvalue of the component of the angular momentum parallel to the axis of symmetry. The form of the four large components of the wave function relating to their dependence on the azimuthal co-ordinates has been given. The case of Russel-Saunders approximation has been considered in detail and the nature of the components of the wave function for the singlet and triplet states has been discussed. It is shown that the wave function for the ground state of the hydrogen molecule could be expressed as a sum of a set of symmetric functions of which the first term is the Heitler-London function, and that the wave function for a triplet state should be a superposition of anti-symmetric molecular orbitals. It is shown that relativistic theory brings about in a natural manner the facts relating to the ground state of the molecules C₂ and O₂. Finally, some remarks are made concerning the case of molecules for which the spinorbit and the spin-spin couplings are strong.     

A comparison of strain gradient theories with applications to the functionally graded circular micro-plate

The strain gradient theory of Zhou et al. is re-expressed in a more direct form and the differences with other strain gradient theories are investigated by an application on static and dynamic analyses of FGM circular micro-plate. To facilitate the modeling, the strain gradient theory of Zhou et al. is re-expressed in cylindrical coordinates, and then the governing equation, boundary conditions and initial condition for circular plate are derived with the help of the Hamilton's principle. The present model can degenerate into other models based on the strain gradient theory of Lam et al., the couple stress theory, the modified couple stress theory or even the classical theory, respectively. The static bending and free vibration problems of a simply supported circular plate are solved. The results indicate that the consideration of strain gradients results in an increase in plate stiffness, and leads to a reduction of deflection and an increase in natural frequency. Compared with the reduced models, the present model can predict a stronger size effect since the contribution from all strain gradient components is considered, and the differences of results from all these models are diminishing when the plate thickness is far greater than the material length-sale parameter.     

Rank-one convexity and polyconvexity of Hencky-type energies

We investigate a family of isotropic volumetric-isochorically decoupled strain energies based on the Hencky-logarithmic (true, natural) strain tensor log U. The main result of this note is that for n = 2 the considered energies are rank-one convex for suitable values of two material parameters. We also conjecture that there are values of the material parameters such that the corresponding energies are polyconvex. (© 2014 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim)     

Nonlinear Poisson-Boltzmann equation in a model of a scanning tunneling microscope

The nonlinear Poisson-Boltzmann equation is solved in the region between a sphere and a plane, which models the electrolyte solution interface between the tip and the substrate in a scanning tunneling microscope. A finite difference method is used with the domain transformed into bispherical coordinates. Picard iteration with relaxation is used to achieve convergence for this highly nonlinear problem. An adsorbed molecule on the substrate can also be modelled by a superposition of a perturbing potential in a small region of the plane. An approximate analytical solution using a superposition of individual solutions for plane, the adsorbed molecule, and the sphere is also attempted. Results for cases of different potential values on the boundary surfaces and different distances of the sphere from the plane are presented. The results of the numerical method, the approximate analytical method, as well as the previous solutions of the linearized equation are compared. © 1994 John Wiley & Sons, Inc.     

Regularity up to the boundary of solutions to boundary-value problems of the theory of generalized Newtonian liquids

Boundary-value problems describing the stationary flow of a generalized Newtonian liquid are considered. The regularity of solutions to such problems is studied near the boundary. The W ₂ ² -estimate for a solution and the partial regularity of the strain velocity tensor are established. In the two-dimensional case, the complete regularity of the strain velocity tensor is also proved. Bibliography: 12 titles. Translated fromProblemy Matematicheskogo Analiza, No. 16. 1997, pp. 239–265.