LARGE DEFORMATION CONSTITUTIVE LAWS FOR ISOTROPIC THERMOELASTIC MATERIALS BRADLEY J. PLOHR AND JEEYEON N. PLOHR Abstract. We examine the approximations made in using Hooke’s law as a constitutive relation for an isotropic thermoelastic material subjected to large deformation. For a general thermoelastic material, we employ the volume-preserving part of the deformation gradient to facilitate volumetric/shear strain decompositions of the free energy, its first derivatives (the Cauchy stress and entropy), and its second derivatives (the specific heat, Grüneisen tensor, and elasticity tensor). Specializing to isotropic materials, we calculate these constitutive quantities more explicitly. For deformations with limited shear strain, but possibly large changes in volume, we show that the differential equations for the stress involve new terms in addition to the traditional Hooke’s law terms. These new terms are of the same order in the shear strain as the objective derivative terms needed for frame indifference; unless the latter terms are negligible, the former cannot be neglected. We also demonstrate that accounting for the new terms requires that the deformation gradient be included as a field variable. 1. Introduction The partial differential equations governing the motion of an isotropic thermoelastic material are often assumed to consist of the mass and momentum equations ρ̇ + ρv j ;j = 0, (1.1) ρv̇ i − σ ij ;j = 0 (1.2) together with constitutive relations of the incremental, or rate, form −ṗ = K tr d, ij (1.3) ij ṡ = 2G (dev d) (1.4) to determine σ ij = −p δ ij + sij . The notation used here is as follows: ρ is the mass density, v i is the particle velocity vector, σ ij is the Cauchy stress tensor, p := − 13 tr σ is the mean pressure, sij := (dev σ)ij is the deviatoric (i.e., trace-free) part of σ ij , dij := 21 (vi;j + vj;i ) is the rate of deformation tensor, K is the adiabatic bulk modulus, and G is the shear modulus; also, a 3 × 3 matrix A has trace tr A := Ak k and deviator (dev A)i j := Ai j − 13 (tr A)δ i j , a semicolon indicates spatial differentiation (e.g., v i ;j := ∂v i /∂xj ), and a dot represents the convective time derivative (e.g., ρ̇ := ∂ρ/∂t + v k ρ;k ). Whereas Eqs. (1.1) and (1.2) reflect fundamental physical principles (the conservation of mass and Newton’s law), the constitutive relations (1.3) and (1.4), which embody the incremental form of Hooke’s law, are only approximate. Indeed, they lack three properties. 2000 Mathematics Subject Classification. Primary 74A20; Secondary 74B15. Key words and phrases. elastic material, constitutive behavior, finite strain. Supported by the U.S. Department of Energy. 1 2 B. PLOHR AND J. PLOHR (1) Frame indifference. Equation (1.4) is not preserved by superposed rigid-body motions. This problem is addressed by replacing ṡij on the left-hand side by an objective time derivative of sij , e.g., its Zaremba-Jaumann [22, 8] or Green-NaghdiMcInnis [6, 5] derivative. However, various objective derivatives are available. Therefore, if one insists on the form of the right-hand side of Eq. (1.4), the question arises as to which objective derivative to choose (see, e.g., Ref. [9]). (2) Thermodynamic consistency. The constitutive coefficients K and G are usually taken to be constants, but basic thermodynamics principles require them to depend on the state of deformation of the material [17]. To find the correct form of this dependence, these coefficients should be calculated as second derivatives of the Helmholtz free energy with respect to strain. (3) Conservative form. Because the constitutive relations Eqs. (1.3) and (1.4) are not in conservative form, they cannot be used when the flow contains discontinuities such as shock waves. (In contrast, the mass and momentum equations (1.1) and (1.2) have well-known conservative forms.) Constitutive relations like Eqs. (1.3) and (1.4) can be replaced by conservation laws if equations for the deformation gradient, rather than the stress, are adopted [14, 19, 15]. In this paper, we derive conservative Eulerian governing equations and constitutive relations for isotropic thermoelastic materials. The keys to removing the deficiencies of Eqs. (1.3) and (1.4) are (a) the introduction of the deformation gradient as a field variable and (b) the derivation of constitutive relations from the free energy. After carrying out the calculation of the first and second derivatives of the free energy in detail, we find that the incremental stress law contains new terms of the same order in the shear strain as the objective derivative terms needed for frame indifference. As such objective derivative terms can significantly affect the predictions of a constitutive model [9], the new terms cannot be neglected; we illustrate their effect in shear flow. However, because of the new terms, the governing system of equations in incremental form does not close. The remedy is to include the deformation gradient as a field variable and solve the additional partial differential equations that governs it. The paper is structured as follows. After briefly reviewing, in Secs. 2 and 3, the Lagrangian and Eulerian descriptions of the motion of a continuum, including the conservative formulation of the governing equations, we discuss the constitutive assumptions for a thermoelastic material in Sec. 4. Then, in Sec. 5, we decompose the strain into its volumetric and shear parts and calculate the corresponding decompositions of various constitutive quantities. The formulae we derive are applied to the case of an isotropic material in Sec. 6. Approximations that are appropriate when the shear strain is small are analyzed in Sec. 7. In Sec. 8, we contrast our constitutive equations with others that are commonly used. Finally, in Sec. 9, we present our conclusions. 2. Lagrangian Description In describing the motion of a material body, we use two systems of coordinates: material coordinates that label the points of the body and spatial coordinates that label the possible positions of the material points. Because it is useful conceptually to distinguish these coordinate systems, we denote material coordinates by X α , α = 1, 2, 3, and spatial coordinates by xi , i = 1, 2, 3. The Lagrangian (or material) description of the motion uses fields that are functions of material coordinates, whereas the fields in the Eulerian (or spatial) description are functions of spatial coordinates. It is likewise helpful to distinguish Lagrangian and LARGE DEFORMATION ISOTROPIC THERMOELASTICITY 3 Eulerian tensors. For example, we denote the particle velocity by V j when it is regarded as a function of X α and t, whereas we employ the notation v j when it is regarded as a function of xi and t. Our focus in this paper is the Eulerian description, but as a preliminary step we recall some basic results concerning the Lagrangian description [10, 2]. 2.1. Kinematics. Having chosen a reference configuration for the body (e.g., the undeformed configuration), let each point of the body be labeled by its material coordinates X α , α = 1, 2, 3, in this configuration. The evolution of the body is then characterized by a timedependent map x̂i , called the motion, that specifies the spatial coordinates xi , i = 1, 2, 3, of each material point X α at time t: xi = x̂i (X, t). (2.1) If X α is held fixed, then Eq. (2.1) describes the trajectory of the material point labeled by X α . Therefore this particle moves with velocity V i (X, t), where V i := ∂ x̂i . ∂t (2.2) On the other hand, with t held fixed, Eq. (2.1) characterizes the deformation of the body at time t. Indeed, neighboring material points X α and X α + dX α are placed at the spatial positions x̂i (X, t) and x̂i (X, t) + F i α (X, t) dX α , respectively, where F i α ∂ x̂i := ∂X α (2.3) is the deformation gradient. 2.2. Conservation laws. The motion of a body is governed by the principles of conservation of mass, momentum, and energy. Momentum conservation, for instance, means that the acceleration of material points is driven by the internal stress in the body. (For simplicity, we dispense with body forces; we also omit heat supply and conduction terms from the energy equation.) In the Lagrangian description, these conservation principles take the form ρ̇0 = 0, ¡ ¢ ρ0 V̇ i − F i α S αβ ;β = 0, ¡ ¢· ¡ ¢ ρ0 12 Vk V k + E − Vi F i α S αβ ;β = 0, (2.4) (2.5) (2.6) where ρ0 is the mass per unit material volume, S αβ is the symmetric Piola-Kirchhoff stress tensor, and E is the specific internal energy. Remark. If the material coordinates are Cartesian, a semicolon indicates differentiation with respect to the material coordinate with t fixed, and a dot represents the time derivative with X α fixed. More generally, the Lagrangian formulae in this paper are true for curvilinear coordinates provided that semicolons and dots are interpreted as covariant derivatives and provided that material indices are raised and lowered using the material metric tensor. 4 B. PLOHR AND J. PLOHR 2.3. Compatibility conditions. In a thermoelastic material, the stress is determined by the deformation gradient F i α together with a thermodynamic variable (such as the specific internal energy or the temperature). Therefore the motion x̂i appears in Eqs. (2.4)–(2.6) only through its first derivatives F i α and V i . By expanding the set of dynamical equations, the motion can be eliminated in favor of its first derivatives, as follows [7]. The motion x̂i can be reconstructed from F i α and V i provided that these quantities satisfy the compatibility conditions Ḟ i α − V i ;α = 0, (2.7) ²αβγ F i β;γ = 0, (2.8) which are obtained by equating mixed partial derivatives of x̂i . These conditions rule out tearing and inter-penetration of the material. We refer to Eq. (2.7) as the Lagrangian continuity equation and to Eq. (2.8) as the Lagrangian curl-free condition. The curl-free condition can be viewed as an initial-value constraint, because the continuity equation implies that ²αβγ Ḟ i β;γ = 0, so that Eq. (2.8) holds at any time if it is satisfied at the initial time. Assuming that the Piola-Kirchhoff stress is known, Eqs. (2.4)–(2.7) form a closed system of dynamical equations for ρ0 , V i , E, and F i α . Thus, solving for the motion x̂i itself can be avoided. The Eulerian analog of this feature is important. 3. Eulerian Description In the Eulerian description, the evolution of a material body can be characterized in various ways [14, 19]. In this paper, we shall follow Ref. [19] by using the inverse motion. 3.1. Eulerian kinematics. The inverse motion X̂ α is defined so that X̂ α (·, t) is the inverse of x̂i (·, t) for each fixed time t. Thus X̂ α (x, t) is the label of the material point that is located at the spatial position xi at time t: X α = X̂ α (x, t). (3.1) As x̂i (X̂(x, t), t) ≡ xi , differentiation with respect to xj yields the relation F i α (X̂(x, t), t) g α j (x, t) = δ i j , (3.2) where g α i := ∂ X̂ α . ∂xi (3.3) Therefore this tensor, called the inverse deformation gradient, is merely the inverse of F i α , viewed as a function of xi and t. Similarly, differentiation with respect to t shows that F i α (X̂(x, t), t) [∂ X̂ α /∂t](x, t) + v i (x, t) = 0, i.e., ∂ X̂ α /∂t = −g α i v i , where v i (x, t) := V i (X̂(x, t), t) (3.4) is the particle velocity as a function of xi and t. Thus the first derivatives of X̂ α are determined by g α i and v i , which are the Eulerian counterparts of F i α and V i . LARGE DEFORMATION ISOTROPIC THERMOELASTICITY 5 3.2. Eulerian conservation laws. Let ρ denote the mass per unit spatial volume, σ ij the Cauchy stress, and ε the specific internal energy, all viewed as functions of xi and t. These Eulerian fields, evaluated at a point xi and time t, are related to corresponding Lagrangian fields, evaluated at X α = X̂ α (x, t) and t, in the following manner: ρ = J −1 ρ0 , (3.5) vi = V i, (3.6) σ ij = J −1 F i α S αβ F j β , (3.7) ε = E. (3.8) Here J is the determinant of the deformation gradient, i.e., the ratio of spatial to material volume. In these terms, the Eulerian conservation laws are [10, 2] ¡ ¢ ρ;t + ρv j ;j = 0, (3.9) ¡ i¢ ¡ i j ¢ ρv ;t + ρv v − σ ij ;j = 0, (3.10) ¢¤ £ ¡ ¢ ¤ £ ¡1 ρ 2 vk v k + ε ;t + ρ 12 vk v k + ε v j − vi σ ij ;j = 0. (3.11) Remark. If the material coordinates are Cartesian, spatial differentiation is carried out with t fixed, and time differentiation holds xi fixed. More generally, the Eulerian formulae in this paper are true for curvilinear coordinates provided that semicolons are interpreted as covariant derivatives and provided that spatial indices are raised and lowered using the spatial metric tensor. 3.3. Compatibility conditions. The derivation and meaning of the compatibility conditions for the inverse motion X̂ α is similar to that for x̂i . Equating mixed partial derivatives of X̂ α yields the equations ¡ ¢ (g α i );t + g α j v j ;i = 0, (3.12) ²ijk g α j;k = 0, (3.13) which are called the Eulerian continuity equation and the Eulerian curl-free condition, respectively. The curl-free condition¡ can be ¢viewed as an initial-value constraint, because the continuity equation implies that ²ijk g α j;k ;t = 0, so that Eq. (3.13) holds at any time if it is satisfied at the initial time. Provided that the Cauchy stress is known, Eqs. (3.9)–(3.12) form a closed system of dynamical equations for ρ, v i , ε, and g α i ; there is no need to solve for the inverse motion X̂ α itself. 4. Constitutive Assumptions The governing equations for thermoelastic flow are supplemented by constitutive relations that determine, for instance, the stress. As mentioned in the introduction, these relations can take the form of differential equations, but such equations are not in conservative form, so their meaning for discontinuous solutions is problematic. Instead, we specify the specific Helmholtz free energy as a function of the strain and the temperature. Then fundamental thermodynamic principles determine the constitutive relations in terms of derivatives of the free energy. This is because deforming a thermoelastic body, or changing its temperature, causes its free energy to vary, which leads to internal stress. 6 B. PLOHR AND J. PLOHR More precisely, we assume that the material is homogeneous (for simplicity) and thermoelastic, and that it satisfies the axioms of locality, entropy production, and frame indifference. We now briefly explain these assumptions and their consequences. (Details can be found in Refs. [10, 2], for example.) The assumption of homogeneity precludes the dependence of ρ0 and the constitutive relations on X α . For a thermoelastic material, the constitutive quantities (namely, the stress, free energy, entropy, and heat flux) are determined by (possibly the entire history of) the motion and the temperature. The locality and entropy production axioms imply, through the Coleman-Noll argument, that the free energy at a point depends solely on the values for the deformation gradient and the temperature at that point, and that the derivatives of the free energy with respect to these variables give the stress and entropy. Frame indifference requires the free energy to be unaffected by spatial rotations, i.e., the free energy depends only on the squared spatial distance between neighboring points ¢ ¡ k β α α α α X and X + dX . This squared distance is (Fkα dX ) F β dX = Cαβ dX α dX β , where Cαβ := Fkα F k β is the right Cauchy-Green tensor. Therefore the free energy depends on F i α solely through Cαβ , or equivalently through the Lagrangian strain tensor Eαβ := 12 (Cαβ − δαβ ). (4.1) (For a discussion of the relationship between this tensor and the infinitesimal strain tensor, which is used in classical linear elasticity theory, see Sec. 5.1.) 4.1. Thermoelastic response. We henceforth adopt the Eulerian description and regard the tensors F j β , Cαβ , and Eαβ as functions of xi and t. (That is, we do not bother to use different notation for these nominally Lagrangian quantities.) Then the Eulerian material response is determined by the specific Helmholtz free energy ψ = ψ̂(E, θ) (4.2) expressed as a function of the Lagrangian strain tensor Eαβ and the temperature θ. As a consequence of the Coleman-Noll argument [10, 2], such a choice for the free energy entails the constitutive relations ¯ ∂ψ ¯¯ j ij i (4.3) σ = ρF α F β, ∂Eαβ ¯θ ¯ ∂ψ ¯¯ η=− , (4.4) ∂θ ¯E ε = ψ +θη (4.5) for the Cauchy stress tensor σ ij , the specific entropy η, and the specific internal energy ε. Once ψ = ψ̂(E, θ) has been given, the conservation laws (3.9)–(3.12) supplemented by the constitutive relations (4.3)–(4.5) form a complete system of conservation laws for the flow variables ρ, v i , θ, and g α i . 4.2. Differentials. We shall have need for the differentials of the constitutive relations. As ¯ ¯ ∂ψ ¯¯ ∂ψ ¯¯ dEαβ + dθ, (4.6) dψ = ∂Eαβ ¯θ ∂θ ¯E ¤ £ Eqs. (4.3) and (4.4) along with the formula dEαβ = 12 F k α dFkβ + (dFkα ) F k β show that ρ dψ = σ ij (dFiβ )(F −1 )β j − ρη dθ. (4.7) LARGE DEFORMATION ISOTROPIC THERMOELASTICITY 7 In particular, Eq. (4.5) implies that ρ dε = σ ij (dFiβ )(F −1 )β j + ρθ dη. (4.8) Thus ε is naturally regarded as a function of Eαβ and η. By solving Eq. (4.4) for θ as a function of (E, η) and substituting for θ in Eq. (4.5), we obtain ε = ε̌(E, η). Similarly, the differentials of Eqs. (4.3) and (4.4) are ¯ ∂ 2 ψ ¯¯ ij i j dσ = ρF α F β dEγδ + (dF i α )(F −1 )α k σ kj ¯ ∂Eαβ ∂Eγδ θ (4.9) ∂ 2ψ j ik j −1 β ij −1 i F β dθ, + σ (dF β )(F ) k + σ ρ dρ + ρF α ∂Eαβ ∂θ ¯ ∂ 2ψ ∂ 2 ψ ¯¯ dη = − dθ. (4.10) dEαβ − ∂Eαβ ∂θ ∂θ2 ¯ E It is standard to define the isothermal elasticity tensor cθijk` , the Grüneisen tensor γ ij , and the specific heat at constant strain cE by ¯ ∂ 2 ψ ¯¯ k ` ijk` i j cθ := ρF α F β (4.11) F γF δ, ∂Eαβ ∂Eγδ ¯θ ∂2ψ −cE γ ij := F i α F jβ, (4.12) ∂Eαβ ∂θ ¯ cE ∂ 2 ψ ¯¯ − := (4.13) . θ ∂θ2 ¯ E Therefore dσ ij = cθijk` (dFkγ )(F −1 )γ ` + (dF i α )(F −1 )α k σ kj + σ ik (dF j β )(F −1 )β k + σ ij ρ−1 dρ − ρcE γ ij dθ, cE dη = cE γ ij (dFiγ )(F −1 )γ j + dθ. θ Eliminating dθ in favor of dη yields alternative forms of these identities: dσ ij = c ijk` (dFkγ )(F −1 )γ ` + (dF i α )(F −1 )α k σ kj + σ ik (dF j β )(F −1 )β k + σ ij ρ−1 dρ − ρθγ ij dη, θ dθ = −θγ ij (dFiγ )(F −1 )γ j + dη, cE (4.14) (4.15) (4.16) (4.17) where the adiabatic elasticity tensor c ijk` is defined to be c ijk` := cθijk` + ρcE θγ ij γ k` . (4.18) 4.3. Incremental form. We now derive the exact incremental form of the constitutive relations. We assume that the flow is smooth. (The following manipulations are not applicable in the presence of discontinuities.) As is well-known, Eqs. (1.1) and (1.2) follow from Eqs. (3.9) and (3.10), and these equations together with Eq. (3.11) imply that ρε̇ − σ ij vi;j = 0. (4.19) 8 B. PLOHR AND J. PLOHR Furthermore, by Eq. (3.12), (g α i );t + v j g α j;i + g α j v j ;i = 0; using Eq. (3.13), the second term in this equation becomes v j g α i;j , so that In other words, In particular, ġ α i + g α j v j ;i = 0. (4.20) ¡ ¢α ¡ ¢j Ḟ j α F −1 i = − g −1 α ġ α i = v j ;i . (4.21) ¡ ¢α v k ;k = Ḟ k α F −1 k = J −1 J˙ = −ρ−1 ρ̇. (4.22) In Eq. (4.8), interpret the differential as the convective time derivative and use Eq. (4.21): ρε̇ = σ ij vj;i + ρθη̇. (4.23) Comparing this result to Eq. (4.19), we find that η̇ = 0, (4.24) i.e., the specific entropy is constant along particle paths. (More generally, ρθη̇ equals the dissipation, such as that associated with internal variables, minus the divergence of the heat flux vector plus the heat supply per unit spatial volume.) Therefore ρε̇ = σ ij dij , (4.25) where dij = 12 (vi;j + vj;i ) is the rate of deformation tensor. Similarly, Eqs. (4.16) and (4.17) become σ̇ ij − v i ;k σ kj − σ ik v j ;k + σ ij tr d = c ijk` dk` , ij θ̇ = −θγ dij . (4.26) (4.27) The quantity on the left-hand side of Eq. (4.26) is known as the Truesdell objective stress rate [20]. An alternative form of Eq. (4.26) is σ̇ ij − ω i k σ kj − σ ik ω j k = bijk` dk` , where ωij := 12 (vi;j − vj;i ) is the vorticity tensor, so that vi;j = dij + ωij , and ¡ ¢ bijk` := c ijk` + 12 σ ik δ j` + σ i` δ jk + σ jk δ i` + σ j` δ ik − σ ij δ k` (4.28) (4.29) is the adiabatic Birch-Wallace elasticity tensor [1, 21]. Notice that this tensor does not have the same complete symmetry that the tensor c ijk` has: in general, bk`ij 6= bijk` . The quantity on the left-hand side of Eq. (4.28) is the Zaremba-Jaumann objective stress rate [22, 8]. 4.4. Volumetric/shear strain decomposition. The incremental stress equation can be decomposed into its volumetric and shear parts which correspond to the decomposition of the Cauchy stress σ ij = −pδ ij + sij into the mean pressure p = − 31 tr σ and the stress deviator sij = (dev σ)ij . To this end, let us introduce the following volumetric/shear strain decomposition of a tensor Aijk` : ijk` ij k` Aijk` = Av,v δ ij δ k` + δ ij Ak` v,s + As,v δ + As,s , (4.30) LARGE DEFORMATION ISOTROPIC THERMOELASTICITY 9 where Av,v := 19 Am m n n , ¡ m k` 1 m n k` ¢ 1 Ak` , v,s := 3 A m − 3 A m n δ ¢ ¡ ijn 1 1 m n ij Aij , n − 3 A m nδ s,v := 3 A (4.31) ijk` − 13 δ ij Am m k` − 31 Aijn n δ k` + 19 Am m n n δ ij δ k` . Aijk` s,s := A (4.34) (4.32) (4.33) k` ij k` ijk` The tensor bijk` decomposes as bijk` = Kδ ij δ k` +δ ij bv,s + bs,v δ + bs,s , where K := 19 bm m n n ij k`ij ijk` ij 6= bv,s in general; denotes the adiabatic bulk modulus. Because b can differ from b , bs,v ij ij − sij . By contrast, for the volumetric/shear decomposition of the tensor = bv,s in fact, bs,v ij ij . The relationship between the decompositions of bijk` and c ijk` is as follows: = cv,s c ijk` , cs,v K = cv,v + 31 p, ijk` bs,s = ijk` cs,s ¡ (4.35) k` k` bv,s = cv,s + 23 sk` , ij ij bs,v = cv,s − 13 sij , ¢ δ i` δ jk − 23 δ ij δ k` ¢ i` jk jk i` j` ik ik j` −p δ δ + ¡ + 12 sik δ j` + s δ +s δ +s δ (4.36) (4.37) − 23 sij δ k` − 23 δ ij sk` . (4.38) Making use of the volumetric/shear decomposition of bijk` , we find that Eq. (4.28) is equivalent to the pair of equations ij i k` −ṗ = K tr d + bv,s (dev d)k` , (4.39) kj (4.40) ik ṡ − ω k s − s ω j k = ij bs,v tr d + ijk` bs,s (dev d)k` , which should be compared with the equations (1.3) and (1.4) that are usually adopted. Similarly, Eqs. (4.25) and (4.27) can be written ρε̇ = −p tr d + sij (dev d)ij , (4.41) θ̇ = −θΓ tr d − θγsij (dev d)ij , (4.42) where Γ := 13 tr γ is the mean Grüneisen coefficient and γsij := (dev γ)ij is the deviatoric Grüneisen tensor. 4.5. Acoustic speeds. The system of conservation laws (3.9)–(3.12) supplemented by the constitutive relations (4.3)–(4.5) can be analyzed to determine the speeds of waves that propagate in a given direction ni . Besides the modes that propagate at the speed nk v k of particles, there are acoustic modes. Finding the speeds of the acoustic modes is accomplished most easily by substituting a traveling wave Ansatz for v i and σ ij into Eqs. (1.2) and (4.26). Letting ξ = nk xk − sn t and inserting the forms v i (x, t) = ṽ i (ξ) and σ ij (x, t) = σ̃ ij (ξ) into these equations yields −cn ρ(ṽ i )0 − (σ̃ ij )0 nj = 0, ij 0 i 0 −cn (σ̃ ) − (ṽ ) nk σ kj ik j 0 ij k 0 − σ (ṽ ) nk + σ (ṽ ) nk = c (4.43) ijk` 0 (ṽk ) n` , (4.44) where cn = sn − nk v k and a prime denotes differentiation with respect to ξ. Therefore ¢ ¡ ρc2n (ṽ i )0 = nj c ijk` + δ ik σ j` n` (ṽk )0 , (4.45) 10 B. PLOHR AND J. PLOHR i.e., (ṽ i )0 is an eigenvector, with eigenvalue ρc2n , of the acoustic matrix (an )i k := nj aij k ` n` , as defined in terms of the acoustic tensor aijk` := c ijk` + δ ik σ j` . The eigenvalues of (an )i k typically form three families parameterized by the direction ni , each giving rise to two propagation velocities, sn = nk v k ± cn . For example, in a material that is nearly isotropic, s,2 two families correspond to shear wave speeds cs,1 n and cn and the third corresponds to the longitudinal wave speed cln . 5. Volumetric/Shear Strain Decomposition Consider a material that can sustain only limited elastic shear strain but responds elastically to large changes in volume. For example, a ductile metal exhibits this feature because plasticity limits the elastic shear strain to less than roughly the yield strength divided by the shear modulus, about 1%. For such a material, it is useful to decompose the specific free energy ψ as a sum of two parts: ψv , obtained by replacing Cαβ by its corresponding volumetric part J 2/3 δαβ ; and the remaining part, ψs . We shall see that the stress associated to the term ψv is spherical (i.e., proportional to the identity tensor), as in hydrodynamics, and that the term ψs vanishes when there is no shear strain. We refer to ψ = ψv + ψs as the volumetric/shear strain decomposition of ψ. The formulae in this section and the next do not assume that the shear strain is small, but they suggest useful approximations that we make in Sec. 7. 5.1. Shear strain. To distinguish the material response to volumetric and shear strain, it is helpful to introduce the volume-preserving part F̄ i α := J −1/3 F i α of the deformation gradient [4, 16], which satisfies det F̄ = 1. The corresponding right Cauchy-Green tensor is C̄αβ := F̄kα F̄ k β = J −2/3 Cαβ , and the corresponding Lagrangian strain tensor is Ēαβ := 12 (C̄αβ − δαβ ). (5.1) As det C̄ = 1, C̄αβ has only five independent components. Therefore the six components of the tensor Cαβ can be replaced by J and C̄αβ . Equivalently, Eαβ can be replaced by τ and Ēαβ , where τ := ρ−1 is the specific volume. As we demonstrate presently, the tensor Ēαβ is a large-deformation generalization of the standard measure of shear strain in classical linear elasticity theory. Therefore τ and Ēαβ represent a separation of the strain into its volumetric and shear parts. For the rest of this subsection, we assume that both the material and spatial coordinates are Cartesian, so that we can (a) identify material and spatial tensor indices and (b) regard material and spatial positions as vectors that can be subtracted. Then we can define uj (x, t) := xj − X̂ j (x, t), the particle displacement as a function of xi and t. Let (∇u)j i := uj ;i = δ j i − g j i be its gradient. In linear elasticity theory, the displacement gradient is assumed to be small enough to justify the neglect of terms that are of second order in this quantity. The infinitesimal strain tensor is defined to be εij := 12 (ui;j + uj;i ), and the measure of shear strain is taken to be the infinitesimal strain deviator (dev ε)ij . (The tensor εij should not be confused with the specific internal energy ε, which is a scalar.) To relate (dev ε)αβ and Ēαβ , let us calculate using matrix notation. First notice that, ¢−1 ¡ and g = I − ∇u, because C = F T F = gg T ¤−1 ¢ £ ¡ (5.2) I + 2E = I − ∇u − (∇u)T + (∇u)(∇u)T = I + 2ε + O k∇uk2 LARGE DEFORMATION ISOTROPIC THERMOELASTICITY 11 as k∇uk → 0. (We define the norm kAk of a matrix A by kAk2 := tr(AT A).) Therefore ¢ ¡ Eαβ = εαβ + O k∇uk2 (5.3) as k∇uk → 0. Next notice that C̄ = exp[dev(ln C)], as follows from diagonalizing C. Therefore I + 2Ē = exp{dev [2E + O(kEk2 )]} = I + 2 dev E + O(kEk2 ) as kEk → 0. Consequently, Ē = dev E + O(k∇uk2 ) as k∇uk → 0, so that Ēαβ = (dev ε)αβ + O(k∇uk2 ) (5.4) as k∇uk → 0. Thus Ēαβ is a large-deformation generalization of (dev ε)αβ ; we refer to it as the Lagrangian shear strain tensor. Remark. In classical linear elasticity theory, the approximate relation ε̇ij ≈ dij is invoked to show the equivalence of the incremental law σ̇ ij ≈ c ijk` dk` (cf. Eq. (4.26)) and Hooke’s law σ ij ≈ c ijk` εk` . Note, however, that ε̇ij is not exactly the same as the rate of deformation tensor dij = 12 (vi;j + vj;i ). In fact, (ui;j )· 6= (u̇i );j = vi;j because the convective derivative does not commute with spatial derivatives; rather, Eq. (4.21) implies that (ui;j )· = vi;j − ui;k v k ;j . ¡ ¢· For this reason, c ijk` dk` 6= c ijk` εk` even if c ijk` is constant, and Eq. (4.26) does not lead to, or follow from, the relation σ ij = c ijk` εk` even if the velocity gradient terms are negligible. 5.2. Decomposition of the free energy. The specific Helmholtz free energy ψ = ψ̂(E, θ) determines the thermoelastic response of the material. There is a unique decomposition of ψ of the form ψ = ψv (τ, θ) + ψs (τ, Ē, θ) (5.5) such that ψs (τ, 0, θ) = 0. Indeed, if Ēαβ = 0, then Cαβ = J 2/3 δαβ , so that Eαβ is determined by τ ; and in this case, Eq. (5.5) implies that ψv (τ, θ) = ψ̂(E, θ). Remark. The thermoelastic response is likewise determined by ε = ε̌(E, η). However, the direct analog for the specific internal energy of the decomposition (5.5), viz., ε = ε̌v (τ, η) + ε̌s (τ, Ē, η), is inappropriate because it would imply that the temperature (which is an intensive thermodynamic quantity), rather than the entropy (which is extensive), is a sum of contributions. This important point has been emphasized to us by R. Menikoff [11]. 5.3. Decompositions of first derivatives of the free energy. The dependence of ψ on τ leads to a volumetric force (i.e., a hydrodynamic pressure) and its dependence on Ēαβ leads to deviatoric (i.e., shear) force, as we now show. To calculate the Cauchy stress from Eq. (4.3), we note that ¯ ¯ ∂ψ ∂ψ ¯¯ ∂J ∂ψ ¯¯ ∂ Ēµν = + . (5.6) ∂Eαβ ∂J ¯Ē ∂Eαβ ∂ Ēµν ¯J ∂Eαβ (In this equation, ∂ψ/∂ Ēαβ must be calculated as if Ēαβ had six independent components, i.e., before invoking the constraint det(I + 2Ē) = 1.) Therefore we need the following formulae [16, p. 358]: J 2/3 ∂ Ēµν ∂Eαβ ∂J = J (C −1 )αβ , ∂Eαβ ¢ ¡ = 12 δ α µ δ β ν + δ α ν δ β µ − 13 (C −1 )αβ Cµν . (5.7) (5.8) 12 B. PLOHR AND J. PLOHR The tensor (5.8) is the projector onto Lagrangian tensors having vanishing contraction with Cαβ . As a result, ∂J j F β = Jδ ij , ∂Eαβ ¯ µ ¶ij ∂ Ēµν j ∂ψ ¯¯ T F β = dev F̄ F̄ . ∂Eαβ ∂ Ē ¯J F iα F i α ¯ ∂ψ ¯¯ ∂ Ēµν ¯J (5.9) (5.10) Thus Eqs. (4.3) and (5.5) imply that the Cauchy stress σ ij takes the form σ ij = −p δ ij + sij , where the mean pressure p = − 13 (5.11) tr σ is decomposed as p := pv (τ, θ) + ps (τ, Ē, θ) with pv := − ∂ψv ∂ψs and ps := − , ∂τ ∂τ and the deviatoric part of the stress, sij = (dev σ)ij , is µ ¶ij ∂ψs T ij ij s = σs := ρ dev F̄ F̄ . ∂ Ē (5.12) (5.13) The volumetric free energy ψv contributes only the pressure pv , whereas the shear free energy ψs generates the deviatoric part of the stress tensor along with the pressure ps . Similarly, the specific entropy, given by Eq. (4.4), is decomposed as ∂ψv ∂ψs and ηs := − . (5.14) ∂θ ∂θ The specific internal energy, if it is regarded as a function of (E, θ), has the decomposition η = ηv (τ, θ) + ηs (τ, Ē, θ) with ηv := − ε = εv (τ, θ) + εs (τ, Ē, θ) with εv := ψv + θηv and εs := ψs + θηs . (5.15) Remark. If ε is regarded as a function of (E, η), a decomposition for ε is found by solving Eq. (5.14)1 for θ as a function of (τ, Ē, η) and substituting for θ in Eq. (5.15)1 . The result, however, is generally not a volumetric/shear strain decomposition for ε̌(E, η). For example, consider the special situation that ∂ 2 ψs /∂θ2 = 0. Then ηs = −∂ψs /∂θ and εs = ψs −θ ∂ψs /∂θ are independent of θ, and so we can omit their θ arguments. If we denote the solution of η 0 = ηv (τ, θ) by θ = θ̌v (τ, η 0 ), the solution of Eq. (5.14)1 is simply θ = θ̌v (τ, η − ηs (τ, Ē)). In this situation, the resulting formula for ε̌(E, η) is ε̌(E, η) = εv (τ, θ̌v (τ, η − ηs (τ, Ē))) + εs (τ, Ē). (5.16) The first term in this decomposition in general exhibits dependence on Ēαβ . 5.4. Decompositions of second derivatives of the free energy. The decomposition of ψ into volumetric and shear terms also entails decompositions of the quantities defined by Eqs. (4.11)–(4.13) and (4.18). First, from Eq. (4.13) we derive that cE = cE,v (τ, θ) + cE,s (τ, Ē, θ) with cE,v := −θ ∂ 2 ψs ∂ 2 ψv and c := −θ . E,s ∂θ2 ∂θ2 (5.17) Next, notice that Eqs. (4.3) and (4.12) imply that ¯ ∂σ ij ¯¯ . − ρcE γ = ∂θ ¯E ij (5.18) LARGE DEFORMATION ISOTROPIC THERMOELASTICITY 13 Therefore the Grüneisen tensor is γ ij = Γδ ij + γsij , where the mean Grüneisen coefficient Γ = 1 3 (5.19) tr γ is decomposed through cE Γ := cE,v (τ, θ)Γv (τ, θ) + cE (τ, Ē, θ)Γs (τ, Ē, θ), (5.20) with Γv := τ ∂pv cE,v ∂θ and Γs := τ ∂ps , cE ∂θ (5.21) and the deviatoric part of the Grüneisen coefficient is γsij τ ∂σsij := − . cE ∂θ (5.22) Finally, we calculate that ¯ ¯ µ ¶ ∂ ∂ψ ¯¯ ∂J ∂ψ ¯¯ ∂ Ēµν ∂ 2ψ = + ∂Eαβ ∂Eγδ ∂Eαβ ∂J ¯Ē ∂Eγδ ∂ Ēµν ¯J ∂Eγδ ¯ ∂ 2 ψ ¯¯ ∂J ∂J ∂ 2 ψ ∂ Ēµν ∂J = + ∂J 2 ¯Ē ∂Eαβ ∂Eγδ ∂ Ēµν ∂J ∂Eαβ ∂Eγδ ¯ ∂ψ ¯¯ ∂J ∂ 2 ψ ∂ Ēµν ∂2J + + ∂J ¯Ē ∂Eαβ ∂Eγδ ∂Eαβ ∂J∂ Ēµν ∂Eγδ ¯ ¯ ∂ Ēµν ∂ 2 ψ ¯¯ ∂ Ēρσ ∂ψ ¯¯ ∂ 2 Ēµν + + . ∂Eαβ ∂ Ēµν ∂ Ēρσ ¯J ∂Eγδ ∂ Ēµν ¯J ∂Eαβ ∂Eγδ (5.23) Equations (5.7) and (5.8) imply that £ ¤ ∂ 2J = −J (C −1 )αγ (C −1 )βδ + (C −1 )αδ (C −1 )βγ − (C −1 )αβ (C −1 )γδ , ∂Eαβ ∂Eγδ ∂ 2 Ēµν J 2/3 ∂Eαβ ∂Eγδ ¡ ¢ ¡ ¢ = − 31 (C −1 )αβ δ γ µ δ δ ν + δ γ ν δ δ µ − 13 δ α µ δ β ν + δ α ν δ β µ (C −1 )γδ £ ¤ + 31 Cµν (C −1 )αγ (C −1 )βδ + (C −1 )αδ (C −1 )βγ + 32 (C −1 )αβ (C −1 )γδ . (5.24) (5.25) Therefore ¡ ¢ ∂2J F k γ F ` δ = −J δ ik δ j` + δ i` δ jk − δ ij δ k` , ∂Eαβ ∂Eγδ ¯ ∂ 2 Ēµν ∂ψ ¯¯ F k γ F `δ ∂ Ēµν ¯J ∂Eαβ ∂Eγδ ¯ ¯ ¶k` ¶ij µ µ ∂ψ ¯¯ ∂ψ ¯¯ T T 2 2 ij F̄ − 3 dev F̄ F̄ δ k` = − 3 δ dev F̄ ∂ Ē ¯J ∂ Ē ¯J ¯ ¶ µ ¡ ik j` ¢ ∂ψ ¯¯ T i` jk 1 2 ij k` + 3 tr F̄ F̄ δ δ + δ δ − δ δ . 3 ∂ Ē ¯J F iαF j β F iαF j β (5.26) (5.27) 14 B. PLOHR AND J. PLOHR Also, by Eq. (5.10), ¯ ∂ Ēµν ∂ 2 ψ ¯¯ ∂ Ēρσ k ` F αF β F γF δ ∂Eαβ ∂ Ēµν ∂ Ēρσ ¯J ∂Eγδ µ = F̄ ⊗ F̄ : i j ¯ ¶ijk` ∂ 2 ψ ¯¯ T T : F̄ ⊗ F̄ . ∂ Ē∂ Ē ¯J s,s (5.28) Combining these formulae with Eqs. (4.11) and (4.18) shows that the adiabatic elasticity tensor is ij k` k` ijk` c ijk` = (K − 31 p)δ ij δ k` + cv,s δ + δ ij cv,s + cs,s , (5.29) where µ ¶ij ∂ 2 ψs T ij 2 ij cv,s := − 3 s + dev F̄ F̄ + ρcE θΓγsij , (5.30) ∂τ ∂ Ē · µ ¶ ¸ ¡ ¢ ∂ψ s ijk` T cs,s := 13 ρ tr F̄ F̄ + p δ ik δ j` + δ i` δ jk − 23 δ ij δ k` ∂ Ē (5.31) µ ¶ijk` ∂ 2 ψs T T ij k` + ρ F̄ ⊗ F̄ : : F̄ ⊗ F̄ + ρcE θγs γs . ∂ Ē∂ Ē s,s Here the adiabatic bulk modulus K is decomposed as K := Kv (τ, θ) + Ks (τ, Ē, θ) (5.32) with Kv := −τ ∂pv + ρcE,v θΓ2v ∂τ and Ks := −τ ¡ ¢ ∂ps + ρθ cE Γ2 − cE,v Γ2v . ∂τ (5.33) 5.5. Alternate thermodynamic variables. In the context of compressible gas dynamics, p is commonly used as a flow variable in place of θ. The specific internal energy is thereby expressed in terms of τ and p, a relation called the incomplete equation of state [12]. (This relation contains less information than does ε expressed as a function of τ and η, in that the temperature and entropy are determined only up to an arbitrary function.) In the present context, it is easier to replace θ by the volumetric pressure p0 rather than the mean pressure p. To this end we solve the relation p0 = pv (τ, θ) to get θ = θ̄v (τ, p0 ), and then substitute for θ in the various functions of (τ, Ē, θ) (viz., ψv , ψs , εv , etc.), obtaining corresponding functions of (τ, Ē, p0 ). 6. Isotropic Constitutive Relations Now we assume that the thermoelastic material response is isotropic in the chosen reference configuration, so that ψ depends on Eαβ solely through the three principal invariants ι1 (C), ι2 (C), and ι3 (C) of the right Cauchy-Green tensor Cαβ . (Here, the principal invariants of a 3 × 3 matrix A are defined so that det(−λI + A) = −λ3 + ι1 (A)λ2 − ι2 (A)λ + ι3 (A). Explicitly, ι1 (A) := tr A, £ ¡ ¢¤ ι2 (A) := 12 (tr A)2 − tr A2 , (6.1) ι3 (A) := det A. (6.3) (6.2) LARGE DEFORMATION ISOTROPIC THERMOELASTICITY 15 The Cayley-Hamilton theorem says that −A3 + ι1 (A)A2 − ι2 (A)A + ι3 (A)I = 0. In particular, it follows that ι2 (A) = (det A) tr(A−1 ) if A is invertible.) An equivalent assumption is that ψs depends on Ēαβ solely through the two principal invariants I¯1 := tr C̄, I¯2 := tr(C̄ −1 ). (6.4) (6.5) (Notice that I¯1 = ι1 (C̄), and that I¯2 = ι2 (C̄) because det C̄ = 1. Also, the third invariant is trivial: ι3 (C̄) = 1.) Therefore we write ψs (τ, Ē, θ) := ψ̆s (τ, I¯1 , I¯2 , θ). 6.1. Shear strain. To understand the meaning of the invariants I¯1 and I¯2 , let us relate them to the infinitesimal strain tensor used in linear elasticity theory. Noting the identity 1 = det C̄ = det(I + 2Ē) = 1 + 2ι1 (Ē) + 4ι2 (Ē) + 8ι3 (Ē), (6.6) we find that tr Ē + (tr Ē)2 − kĒk2 + 4 det Ē = 0. Because tr Ē = O(kĒk) (at least) and det Ē = O(kĒk3 ) as kĒk → 0, this equality implies that tr Ē = O(kĒk2 ) as kĒk → 0. Consequently, 1 ¯ (I − 3) = tr Ē = kĒk2 + O(kĒk3 ) (6.7) 2 1 as kĒk → 0. Moreover, the identity 8 det Ē = det(−I + C̄) = −1 + ι1 (C̄) − ι2 (C̄) + ι3 (C̄) shows that I¯1 − I¯2 = 8 det Ē, so that 1 ¯ (I 2 2 − 3) = kĒk2 + O(kĒk3 ) (6.8) as kĒk → 0. In particular, Eq. (5.4) implies that 12 (I¯1 − 3) and 21 (I¯2 − 3) both equal kdev εk2 + O(k∇uk3 ) as k∇uk → 0, with kdev εk being the usual isotropic measure of shear strain in linear elasticity theory. The foregoing results suggest introducing the quantities ²1 ≥ 0 and ²2 ≥ 0 defined by ²2a := 12 (I¯a − 3), a = 1, 2. (6.9) The small shear strain regime is defined by the following equivalent assumptions: kĒk ¿ 1, or ²1 ¿ 1, or ²2 ¿ 1. In contrast, the linearized regime is defined by k∇uk ¿ 1. By Eq. (5.4), kĒk = O(k∇uk); but as the example of F i α being a nontrivial rotation shows, k∇uk 6= O(kĒk). In other words, the small shear strain regime is broader than the linearized regime. 6.2. Deviatoric stress. To compute the deviatoric stress, first note that ∂ ψ̆s ∂ I¯1 ∂ ψ̆s ∂ I¯2 ∂ψs = ¯ + ¯ . ∂ Ēαβ ∂ I1 ∂ Ēαβ ∂ I2 ∂ Ēαβ (6.10) By definition of I¯1 and I¯2 , ∂ I¯1 = 2δ αβ , ∂ Ēαβ ∂ I¯2 = −2(C̄ −2 )αβ . ∂ Ēαβ (6.11) (6.12) 16 B. PLOHR AND J. PLOHR Therefore ∂ I¯1 j F̄ β = 2b̄ij , ∂ Ēαβ ∂ I¯2 j F̄ i α F̄ β = −2(b̄−1 )ij , ∂ Ēαβ F̄ i α (6.13) (6.14) where b̄ij := F̄ i γ F̄ jγ = J −2/3 bij denotes the volume-preserving part of the left Cauchy-Green tensor bij := F i γ F j γ . Observe that tr b̄ = I¯1 and tr(b̄−1 ) = I¯2 . Remark. Equalities relying on the constraint det C̄ = 1 cannot be invoked prior to calculating derivatives with respect to Ēαβ . For example, I¯2 = ι2 (C̄) because det C̄ = 1, but when we are treating Ēαβ as if it had six independent components, ∂ I¯2 /∂ Ēαβ 6= ∂ι2 (C̄)/∂ Ēαβ . By Eq. (5.13) and Eqs. (6.13)–(6.14), the deviatoric part of the Cauchy stress tensor is ∂ ψ̆s ∂ ψ̆s sij = 2ρ ¯ (dev b̄)ij − 2ρ ¯ [dev(b̄−1 )]ij . ∂ I1 ∂ I2 (6.15) To see the significance of the tensors (dev b̄)ij and [dev(b̄−1 )]ij appearing here, notice that b̄ = exp[dev(ln b)], as follows from diagonalizing b, and that £ ¤−1 b = (g T g)−1 = I − ∇u − (∇u)T + (∇u)T (∇u) = I + 2ε + O(k∇uk2 ) (6.16) as k∇uk → 0. Consequently, b̄ = exp [2 dev ε + O(k∇uk2 )] = I + 2 dev ε + O(k∇uk2 ) as k∇uk → 0, so that 1 (dev b̄)ij 2 −1 ij − 12 [dev(b̄ = (dev ε)ij + O(k∇uk2 ), ij 2 )] = (dev ε) + O(k∇uk ) (6.17) (6.18) as k∇uk → 0. Thus these tensors generalize the infinitesimal strain deviator of linear elasticity theory. Also notice that kdev b̄k = kdev C̄k = 2kdev Ēk and kdev(b̄−1 )k = kdev(C̄ −1 )k = 2kdev Ēk + O(kĒk2 ) as kĒk → 0. This identification motivates introducing the coefficients ∂ ψ̆s Ğa (τ, I¯1 , I¯2 , θ) := 2ρ ¯ , ∂ Ia a = 1, 2; (6.19) then the deviatoric stress (6.15) is sij = Ğ1 (dev b̄)ij − Ğ2 [dev(b̄−1 )]ij . (6.20) By Eqs. (6.17) and (6.18), sij = 2(Ğ1 + Ğ2 )(dev ε)ij + O(k∇uk2 ), so that Ğ1 + Ğ2 can be regarded as the shear modulus. In this notation, the deviatoric part of the Grüneisen coefficient, as given by Eq. (5.22), is # " τ ∂ Ğ ∂ Ğ 2 1 (6.21) (dev b̄)ij − [dev(b̄−1 )]ij . γsij = − cE ∂θ ∂θ LARGE DEFORMATION ISOTROPIC THERMOELASTICITY 17 ij 6.3. Elasticity tensor. By Eq. (5.30), the portion cv,s of the adiabatic elasticity tensor is ∂ 2 ψ̆s ∂ 2 ψ̆s ij (dev b̄) − 2 [dev(b̄−1 )]ij + ρcE θΓγsij . ∂τ ∂ I¯1 ∂τ ∂ I¯2 (6.22) ij cv,s = ζ̆1 (dev b̄)ij − ζ̆2 [dev(b̄−1 )]ij , (6.23) ij cv,s = − 32 sij + 2 In other words, where ijk` The part cs,s 2 ∂(τ Ğa ) ∂ Ğa ζ̆a := − Ğa + − Γθ , a = 1, 2. 3 ∂τ ∂θ defined by Eq. (5.31) involves à ! ∂ ∂ ψ̆s ∂ I¯1 ∂ ψ̆s ∂ I¯2 ∂ 2 ψs = + ¯ ∂ Ēαβ ∂ Ēγδ ∂ Ēαβ ∂ I¯1 ∂ Ēγδ ∂ I2 ∂ Ēγδ (6.24) ∂ 2 ψ̆s ∂ I¯1 ∂ I¯1 ∂ 2 ψ̆s ∂ I¯2 ∂ I¯1 = ¯2 + ∂ I1 ∂ Ēαβ ∂ Ēγδ ∂ I¯2 ∂ I¯1 ∂ Ēαβ ∂ Ēγδ ∂ ψ̆s ∂ 2 I¯1 ∂ 2 ψ̆s ∂ I¯1 ∂ I¯2 + ¯ + ¯ ¯ ∂ I1 ∂ Ēαβ ∂ Ēγδ ∂ I1 ∂ I2 ∂ Ēαβ ∂ Ēγδ + (6.25) ∂ ψ̆s ∂ 2 I¯2 ∂ 2 ψ̆s ∂ I¯2 ∂ I¯2 + . ∂ I¯22 ∂ Ēαβ ∂ Ēγδ ∂ I¯2 ∂ Ēαβ ∂ Ēγδ By Eqs. (6.11) and (6.12), ∂ 2 I¯1 = 0, ∂ Ēαβ ∂ Ēγδ (6.26) h ∂ 2 I¯2 = 2 (C̄ −1 )αγ (C̄ −2 )βδ + (C̄ −1 )αδ (C̄ −2 )βγ ∂ Ēαβ ∂ Ēγδ + (C̄ Therefore µ −2 αγ ) (C̄ −1 βδ ) + (C̄ −2 αδ ) (C̄ −1 βγ ) (6.27) i . ¶ijk` ∂ 2 I¯2 F̄ ⊗ F̄ : : F̄ ⊗ F̄ ∂ Ē∂ Ē h i = 2 δ ik (b̄−1 )j` + δ i` (b̄−1 )jk + (b̄−1 )ik δ j` + (b̄−1 )i` δ jk . (6.28) For any two matrices A and B, let us define the tensor ijk` IA,B := 14 (Aik B j` + Ai` B jk + B ik Aj` + B i` Ajk ). Then by writing (b̄−1 )ij = 31 I¯2 δ ij + [dev(b̄−1 )]ij , we see that µ ¶ijk` ¡ ¢ ∂ 2 I¯2 ijk` F̄ ⊗ F̄ : . : F̄ ⊗ F̄ = 34 I¯2 δ ik δ j` + δ i` δ jk + 8II,dev( b̄−1 ) ∂ Ē∂ Ē Also, by Eqs. (6.14) and (6.14), ¶ µ ∂ψs T ∂ ψ̆s ∂ ψ̆s F̄ = 2I¯1 ¯ − 2I¯2 ¯ . tr F̄ ∂ I1 ∂ I2 ∂ Ē (6.29) (6.30) (6.31) 18 B. PLOHR AND J. PLOHR Combining the foregoing formulae with Eq. (5.31), we obtain " ijk` cs,s = 2 X ¡ # ¢ ¡ ¢ 1 + 23 ²2a Ğa + p δ ik δ j` + δ i` δ jk − 23 δ ij δ k` a=1 ¡ ¢ijk` ∂ Ğ1 + 4Ğ2 II,dev(b̄−1 ) s,s + 2 ¯ (dev b̄)ij (dev b̄)k` ∂ I1 ª ∂ Ğ2 © − 2 ¯ [dev(b̄−1 )]ij (dev b̄)k` + (dev b̄)ij [dev(b̄−1 )]k` ∂ I1 ∂ Ğ2 + 2 ¯ [dev(b̄−1 )]ij [dev(b̄−1 )]k` + ρcE θγsij γsk` . ∂ I2 (6.32) 7. Small Shear Strain As we saw in Sec. 6.1, the invariants ²2a = 21 (I¯a − 3), a = 1, 2, both equal kĒk2 + O(kĒk3 ). In this section, we suppose that the shear strain Ēαβ is small and that we can expand the shear contribution to the specific Helmholtz free energy in a Taylor series around I¯1 = 3, I¯2 = 3, i.e., in powers of ²21 and ²22 . By definition (6.19), ψ = ψv (τ, θ) + 2 X τ Ga (τ, θ) ²2a + O(kĒk4 ), (7.1) a=1 where Ga (τ, θ) := Ğa (τ, 3, 3, θ), a = 1, 2. Neglecting terms of order kĒk4 , we obtain the small shear strain model, for which the shear contribution to the free energy has the form ψ̆s (τ, I¯1 , I¯2 , θ) := 2 X τ Ga (τ, θ) ²2a . (7.2) a=1 For incompressible, isothermal materials, this model coincides with that of Mooney [13]. The quantity Gv := G1 + G2 can be regarded as the shear modulus. The dimensionless quantity α := (G1 − G2 )/(G1 + G2 ) is called the coefficient of asymmetry [13]: if α = 0, the shear of a deformation with b̄ = b̄0 is the negative of that with b̄ = b̄−1 0 . In terms of Gv and α, G1 = 21 (1 + α)Gv and G2 = 12 (1 − α)Gv . Remark. Various models are available for the shear modulus Gv = G1 + G2 . For instance, in the model of Steinberg et al. [18], £ ¤ Gv (τ, θ) := G0 1 + Gp (ρ0 τ )1/3 pv (τ, θ) + Gθ (θ − θ0 ) , (7.3) where G0 , Gp , and Gθ are additional material constants. (For simplicity, we have interpreted the pressure appearing in this model as the volumetric pressure pv .) Values for the coefficient of asymmetry α for rubber are given in Ref. [13]. LARGE DEFORMATION ISOTROPIC THERMOELASTICITY 19 The shear contributions to the mean pressure, deviatoric stress, specific entropy, and specific internal energy, as determined by Eqs. (5.12)–(5.15), are ps = − 2 X ∂(τ Ga ) ∂τ a=1 ij ²2a , (7.4) σsij = G1 (dev b̄) − G2 [dev(b̄−1 )]ij , ηs = −τ εs = τ 2 µ X a=1 2 X ∂Ga ∂θ a=1 ²2a , ∂Ga Ga − θ ∂θ (7.5) (7.6) ¶ ²2a , (7.7) respectively, and the shear contributions to the specific heat and Grüneisen tensor, defined by Eqs. (5.17), (5.21), and (5.22), are cE,s = −τ θ 2 X ∂ 2 Ga a=1 Γs = − γsij τ cE 2 X a=1 ∂θ2 ²2a , (7.8) ∂ 2 (τ Ga ) 2 ² , ∂τ ∂θ a (7.9) ¸ · τ ∂G1 ∂G2 ij −1 ij =− (dev b̄) − [dev(b̄ )] . cE ∂θ ∂θ (7.10) By Eq. (5.33), the shear contribution to the adiabatic bulk modulus is Ks = τ 2 X ∂ 2 (τ Ga ) a=1 ∂τ 2 ¡ ¢ ²2a + ρθ cE Γ2 − cE,v Γ2v ; (7.11) notice that the second term of Ks is of order kĒk2 . Equations (6.23) and (6.24) say that ij cv,s = ζ1 (dev b̄)ij − ζ2 [dev(b̄−1 )]ij , (7.12) where 1 ∂Ga ∂Ga ζa := Ga + τ − Γθ , 3 ∂τ ∂θ a = 1, 2. (7.13) Finally, Eq. (6.32) implies that ijk` = cs,s " 2 X¡ a=1 # ¢ ¢ ¡ 1 + 23 ²2a Ga + p δ ik δ j` + δ i` δ jk − 23 δ ij δ k` ¡ + 4G2 II,dev(b̄−1 ) ¢ijk` s,s + ρcE θγsij γsk` . (7.14) 20 B. PLOHR AND J. PLOHR In these terms, the volumetric/shear strain parts of the tensor bijk` are bv,v = K, k` bv,s ij bs,v ijk` bs,s = = k` cv,s ij cv,s + − (7.15) 2 k` s , 3 1 ij s , 3 (7.16) (7.17) 2 X ¡ ¢ ¡ ¢ = 1 + 32 ²2a Ga δ ik δ j` + δ i` δ jk − 23 δ ij δ k` a=1 ¡ ¢ijk` + 4G2 II,dev(b̄−1 ) s,s + ρcE θγsij γsk` ¡ ¢ + 12 sik δ j` + si` δ jk + sjk δ i` + sj` δ ik − 23 sij δ k` − 23 δ ij sk` . (7.18) Also, the acoustic matrix (an )ik = nj (c ijk` + δ ik σ j` )n` is # " # " 2 2 X X 2 i k 2 2 j` ik (1 + 23 ²a )Ga n n + |n| (1 + 32 ²a )Ga + nj s n` δ ik (an ) = K + 13 £ a=1 ij k i k` ¤ a=1 + ζ1 (dev b̄) nj n + n (dev b̄) n` © ª − ζ2 [dev(b̄−1 )]ij nj nk + ni [dev(b̄−1 )]k` n` ¡ ¢ijk` + 4G2 Ib,dev(b̄−1 ) s,s nj n` + ρcE θγsij nj γsk` n` . (7.19) Remark. In writing Eq. (7.2), we have neglected quadratic terms in 21 (I¯1 − 3) and 21 (I¯2 − 3). If we reinstated such terms, they would give rise to terms of order kĒk4 in ps , ηs , εs , cE,s , ij ijk` Γs , and Ks , terms of order kĒk3 in sij , γsij , and cv,s , and terms of order kĒk2 in cs,s and ijk` ik 2 (an ) . Terms of same order kĒk appear in formulae (7.14) and (7.19) for cs,s and (an )ik . Nonetheless, these terms must be retained to maintain thermodynamic consistency of the constitutive model. If the state of deformation is spherical, meaning that F i α = J 1/3 δ i α , then (dev b̄)ij = 0 = ij [dev(b̄−1 )]ij and ²1 = 0 = ²2 , so that ps , σsij , ηs , εs , cE,s , Γs , γsij , Ks , and cv,s all vanish and the adiabatic elasticity tensor reduces to the classical linear elastic form ¡ ¢ c ijk` = λδ ij δ k` + µ δ ik δ j` + δ i` δ jk (7.20) in terms of the Lamé moduli, λ = Kv − 23 Gv − pv and µ = Gv + pv . Moreover, the acoustic matrix (an )ik := nj (c ijk` + δ ik σ j` )n` is ¢ ¡ (7.21) (an )ik = Kv + 31 Gv ni nk + |n|2 Gv δ ik , so that (if |n| = 1) the eigenvalues of the acoustic matrix are given by the classical formulae: ρ(cs )2 := Gv (with multiplicity two) for shear waves and ρ(cl )2 := Kv + 43 Gv for longitudinal waves. 8. Comparison Let us compare the isotropic, thermoelastic constitutive model of the preceding section, which is exact modulo terms in the free energy of fourth order in the shear strain, to standard constitutive models. LARGE DEFORMATION ISOTROPIC THERMOELASTICITY 21 8.1. Standard constitutive models. Equations (1.3)–(1.4), −ṗ = K tr d, (1.3) ṡij = 2G (dev d)ij , (1.4) are often adopted as the constitutive model for an isotropic material. They differ from the isotropic, thermoelastic incremental equations (4.39)–(4.40), k` −ṗ = K tr d + bv,s (dev d)k` , (4.39) ijk` ij (dev d)k` , tr d + bs,s ṡij − ω i k skj − sik ω j k = bs,v (4.40) in that they omit the following terms: k` (dev d)k` = O(Gv kĒkkdev dk), bv,s ij bs,v tr d = O(Gv kĒk|tr d|), ijk` bs,s (dev d)k` − 2G (dev d)ij = O(Gv kĒkkdev dk), ω i k skj + sik ω j k = O(Gv kĒkkωk). (8.1) (8.2) (8.3) (8.4) (Here and in the following, we identify G as Gv .) The objective derivative terms (8.4) are well known [22, 8], but the other terms (8.1)–(8.3) are new. For the approximate equations (1.3)– (1.4) to be valid, the term (8.1) should be small compared to Kv |tr d| and the terms (8.2)– (8.4) should be small compared to Gv kdev dk. Assuming that Gv 6= 0, the conditions for neglecting these four terms are, respectively, Kv |tr d|, Gv kĒk |tr d| ¿ kdev dk, kĒkkdev dk ¿ (8.5) (8.6) kĒk¿ 1, (8.7) kĒk kωk ¿ kdev dk. (8.8) Another common constitutive model adopts Eq. (1.3) and replaces ṡij on the left-hand side of Eq. (1.4) by the Zaremba-Jaumann [22, 8] objective stress rate: ṡij − ω i k skj − sik ω j k = 2G (dev d)ij . (8.9) In other words, the terms (8.1)–(8.3) are omitted from Eqs. (4.39)–(4.40) but the terms (8.4) are retained. A third constitutive model uses the Green-Naghdi-McInnis [6, 5] objective stress rate on the left-hand side of Eq. (1.4), i.e., ṡij − wi k skj − sik wj k = 2G (dev d)ij . (8.10) Here the antisymmetric tensor wij is defined as follows: find the left polar decomposition of the deformation gradient, namely tensors Ri α and Vij such that F i α = V i k Rk α , Vji = Vij , Vij v i v j ≥ 0 for all vectors v i , and Rkα Rk β = δαβ ; then let wij = Ṙiγ (R−1 )γ j . As in the Zaremba-Jaumann model, the terms (8.1)–(8.3) are omitted from Eqs. (4.39)–(4.40), but here the terms (8.4) are modified. 22 B. PLOHR AND J. PLOHR 8.2. Example. As an illustration of the differences among constitutive models, consider, as an example, simple shear flow: 1 γ 0 F = 0 1 0 , (8.11) 0 0 1 √ where γ varies only with time. In this flow, ²1 = |γ|/ 2 = ²2 , 2 2 1 2 γ γ 0 γ −γ 0 − 3 3 0 , dev(b̄−1 ) = −γ 32 γ 2 0 , dev b̄ = γ − 13 γ 2 (8.12) 1 2 1 2 0 0 −3γ 0 0 −3γ and 0 d = 21 γ̇ 0 0 0, 0 1 γ̇ 2 0 0 0 ω = − 21 γ̇ 0 1 γ̇ 2 0 0 0 0, 0 w= 1 ω. 1 + γ 2 /4 (8.13) Assuming, for simplicity, that G1 = 12 (1 + α)Gv and G2 = 21 (1 − α)Gv are constant, we find that Eqs. (4.39) and (4.40) become ṡ12 −ṗ = 31 Gv γ γ̇ + 23 γ̇s12 , ¢ = 1 + 13 γ 2 Gv γ̇ + γ̇s22 + 16 (1 − α)Gv γ 2 γ̇, ¡ 11 = 22 = ṡ ṡ ṡ33 = 4 γ̇s12 3 − 23 γ̇s12 − 32 γ̇s12 − − + 1 (1 3 1 (1 3 2 (1 3 (8.14) (8.15) − α)Gv γ γ̇, (8.16) − α)Gv γ γ̇, (8.17) − α)Gv γ γ̇. (8.18) The initial condition is that p = 0 and sij = 0 when γ = 0. The solution of the initial-value problem is p = − 12 Gv γ 2 , (8.19) s12 = Gv γ, (8.20) α+3 s11 = Gv γ 2 , (8.21) 6 α−3 s22 = Gv γ 2 , (8.22) 6 α s33 = − Gv γ 2 , (8.23) 3 which, of course, is compatible with Eqs. (7.4) and (7.5). Contrast this result with those for Eqs. (1.3) and (1.4) when the Zaremba-Jaumann [22, 8] or Green-Naghdi-McInnis [6, 5] objective time derivative of sij replaces ṡij on the left-hand side of Eq. (1.4). As shown in Ref. [3], the solution is p = 0, (8.24) s12 = Gv sin γ, s 11 (8.25) 22 = Gv (1 − cos γ) = −s , 33 s =0 (8.26) (8.27) LARGE DEFORMATION ISOTROPIC THERMOELASTICITY 23 1.5 12 shear stress s /Gv isotropic thermoelastic Zaremba-Jaumann Green-Naghdi-McInnis 1 0.5 0 0 0.2 0.4 0.8 0.6 shear strain ε 1 1.2 1.4 12 Figure 8.1. Comparison √ of the nondimensional shear stress s /Gv plotted vs. shear strain ² := |γ|/ 2 for (a) the isotropic, thermoelastic model, (b) the model that uses the Zaremba-Jaumann stress rate, and (c) the model that uses the Green-Naghdi-McInnis stress rate. in the Zaremba-Jaumann case, and the solution is p = 0, (8.28) s12 = 2Gv [(2β − tan β) cos(2β) − 2 ln(cos β) sin(2β)] , £ ¤ s11 = 4Gv cos(2β) ln cos β + β sin(2β) − sin2 β = −s22 , (8.29) s 33 = 0, (8.30) (8.31) where tan β = γ/2, in the Green-Naghdi-McInnis case. Plots of the nondimensional shear 12 11 22 stress √ s /Gv and first normal stress difference (s − s )/Gv vs. shear strain ² := ²1 = ²2 = |γ|/ 2 for the three models are shown in Figs. 8.1 and 8.2. In this example, the new terms (8.1) and (8.3) are comparable in size to the objective derivative terms (8.4). (For simple shear flow, the term (8.2) happens to vanish.) The objective derivative terms, or some replacement for them, are often found to be important for the accuracy of flow simulations. If the objective derivative terms are important, then omitting the new terms generally leads to inaccurate simulations. 9. Conclusions We draw two conclusions from our calculations. (1) The isotropic, thermoelastic incremental equations (4.39)–(4.40) contain not only the well-known objective derivative terms (8.4) but also the new terms (8.1)–(8.3). As 24 B. PLOHR AND J. PLOHR 11 22 normal stress difference (s -s )/Gv 3 isotropic thermoelastic Zaremba-Jaumann Green-Naghdi-McInnis 2.5 2 1.5 1 0.5 0 0 0.2 0.4 0.6 0.8 shear strain ε 1 1.2 1.4 Figure 8.2. Comparison of the nondimensional√first normal stress difference (s11 − s22 )/Gv plotted vs. shear strain ² := |γ|/ 2 for (a) the isotropic, thermoelastic model, (b) the model that uses the Zaremba-Jaumann stress rate, and (c) the model that uses the Green-Naghdi-McInnis stress rate. illustrated by the example of Sec. 8, neglecting the terms (8.1) and (8.3) can have an effect comparable to omitting or modifying the objective derivative terms (8.4), which, in certain flow regimes, can strongly influence the prediction of a constitutive model. In general, we expect that neglecting any of the terms (8.1)–(8.4) leads to significant errors in predictions for large-deformation flow. (2) The new terms (8.1)–(8.3) involve the quantities ²1 , ²2 , (dev b̄)ij , and [dev(b̄−1 )]ij , which cannot be determined from sij . Consequently, unless these terms are omitted, the governing equations in incremental form, namely Eqs. (1.1)–(1.2), (4.39)–(4.40), and (4.42), do not constitute a closed system. 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