On the passage from atomistic systems to nonlinear elasticity theory for general multi-body potentials with p-growth

We derive continuum limits of atomistic models in the realm of nonlinear elasticity theory rigorously as the interatomic distances tend to zero. In particular we obtain an integral functional acting on the deformation gradient in the continuum theory which depends on the underlying atomistic interaction potentials and the lattice geometry. The interaction potentials to which our theory applies are general finite range models on multilattices which in particular can also account for multi-pole interactions and bond-angle dependent contributions. Furthermore, we discuss the applicability of the Cauchy-Born rule. Our class of limiting energy densities consists of general quasiconvex functions and the class of linearized limiting energies consistent with the Cauchy-Born rule consists of general quadratic forms not restricted by the Cauchy relations.

[1]  Anneliese Defranceschi,et al.  Homogenization of Multiple Integrals , 1999 .

[2]  L. Evans Measure theory and fine properties of functions , 1992 .

[3]  Matteo Focardi,et al.  Finite difference approximation of energies in Fracture Mechanics , 2000 .

[4]  B. Schmidt On the Passage from Atomic to Continuum Theory for Thin Films , 2008 .

[5]  B. Kirchheim,et al.  Sufficient conditions for the validity of the Cauchy-Born rule close to SO(n) , 2006 .

[6]  I. Fonseca,et al.  Modern Methods in the Calculus of Variations: L^p Spaces , 2007 .

[7]  X. Blanc,et al.  From Molecular Models¶to Continuum Mechanics , 2002 .

[8]  Stefan Müller,et al.  Homogenization of nonconvex integral functionals and cellular elastic materials , 1987 .

[9]  B. Dacorogna Direct methods in the calculus of variations , 1989 .

[10]  P. Lions,et al.  Atomistic to continuum limits for computational materials science , 2007 .

[11]  Gianni Dal Maso,et al.  An Introduction to [gamma]-convergence , 1993 .

[12]  A. Raoult,et al.  ELASTIC LIMIT OF SQUARE LATTICES WITH THREE-POINT INTERACTIONS , 2012 .

[13]  Bernd Schmidt,et al.  On the derivation of linear elasticity from atomistic models , 2009, Networks Heterog. Media.

[14]  S. Haussühl Die Abweichungen von den Cauchy-Relationen , 1967 .

[15]  Marco Cicalese,et al.  Integral Representation Results for Energies Defined on Stochastic Lattices and Application to Nonlinear Elasticity , 2011 .

[16]  Florian Theil,et al.  Validity and Failure of the Cauchy-Born Hypothesis in a Two-Dimensional Mass-Spring Lattice , 2002, J. Nonlinear Sci..

[17]  Marco Cicalese,et al.  A General Integral Representation Result for Continuum Limits of Discrete Energies with Superlinear Growth , 2004, SIAM J. Math. Anal..

[18]  G. D. Maso,et al.  An Introduction to-convergence , 1993 .