Atomistic to Continuum limits for computational materials science
From MaRDI portal
Publication:5447908
DOI10.1051/m2an:2007018zbMath1144.82018MaRDI QIDQ5447908
Pierre-Louis Lions, Claude Le Bris, Xavier Blanc
Publication date: 20 March 2008
Published in: ESAIM: Mathematical Modelling and Numerical Analysis (Search for Journal in Brave)
Full work available at URL: http://www.numdam.org/item?id=M2AN_2007__41_2_391_0
81V45: Atomic physics
82B21: Continuum models (systems of particles, etc.) arising in equilibrium statistical mechanics
Related Items
On the Infinite Particle Limit in Lagrangian Dynamics and Convergence of Optimal Transportation Meshfree Methods, Analysis of a force-based quasicontinuum approximation, Finite-temperature coarse-graining of one-dimensional models: mathematical analysis and computational approaches, Non-local energetics of random heterogeneous lattices, A new adaptive modeling strategy based on optimal control for atomic-to-continuum coupling simulations, Variational analysis of the asymptotics of the \(XY\) model, Improved continuous models for discrete media, Stability, instability, and error of the force-based quasicontinuum approximation, Finite element analysis of Cauchy-Born approximations to atomistic models, Atomic to continuum passage for nanotubes: a discrete Saint-Venant principle and error estimates
Cites Work
- Theoretical and numerical study of the behaviour of bonded plates
- A multiscale projection method for the analysis of carbon nanotubes
- \(W^{1,p}\)-quasiconvexity and variational problems for multiple integrals
- The heterogeneous multiscale methods
- A proof of crystallization in two dimensions
- Cauchy-Born rule and the stability of crystalline solids: Static problems
- The energy of some microscopic stochastic lattices
- Universality in the Thomas-Fermi-von Weizsäcker model of atoms and molecules
- A note on the regularity of reduced models obtained by nonlocal quasi-continuum-like approaches
- Young measure flow as a model for damage
- Analysis of a prototypical multiscale method coupling atomistic and continuum mechanics: the convex case
- Semilinear equations in \({\mathbb{R}}^ N\) without condition at infinity
- Ergodic theorems. With a supplement by Antoine Brunel
- Variational methods for elastic crystals
- Fine phase mixtures as minimizers of energy
- Equilibrium configurations of crystals
- Characterizations of Young measures generated by gradients
- Convexity conditions and existence theorems in nonlinear elasticity
- The Thomas-Fermi theory of atoms, molecules and solids
- On the non-locality of quasiconvexity
- Variational formulation of softening phenomena in fracture mechanics: The one-dimensional case
- Gradient Young measures generated by sequences in Sobolev spaces
- An introduction to \(\Gamma\)-convergence
- Parametrized measures and variational principles
- Handbook of Numerical Analysis X. Special volume: Computational chemistry.
- Rigorous derivation of nonlinear plate theory and geometric rigidity
- Numerical solution of a virtual internal bond model for material fracture
- On some periodic Hartree-type models for crystals
- A definition of interface energies using atomistic models.
- Variational methods for crystalline microstructure. Analysis and computation
- From molecular models to continuum mechanics
- A dynamic atomistic--continuum method for the simulation of crystalline materials
- Validity and failure of the Cauchy-Born hypothesis in a two-dimensional mass-spring lattice
- Numerical approximation of Young measures in non-convex variational problems
- An adaptive finite element approach to atomic-scale mechanics. -- The quasicontinuum method
- A scheme for the passage from atomic to continuum theory for thin films, nanotubes and nanorods
- Discrete homogenization in graphene sheet modeling
- Discrete to continuum limit for some models of stochastic lattices of atoms
- On the stability of conformal mappings in multidimensional spaces
- The lower quasiconvex envelope of the stored energy function for an elastic crystal
- Quasi-convexity and the lower semicontinuity of multiple integrals
- Relaxation of some multi-well problems
- Variational limit of a one-dimensional discrete and statistically homogeneous system of material points
- Convergence de modèles moléculaires vers des modèles de mécanique des milieux continus
- GEOMETRY OPTIMIZATION FOR CRYSTALS IN THOMAS–FERMI TYPE THEORIES OF SOLIDS
- The Passage from Discrete to Continuous Variational Problems: a Nonlinear Homogenization Process
- Some Open Problems in Elasticity
- Erratum: Prediction of Dislocation Nucleation during Nanoindentation by the Orbital-Free Density Functional Theory Local Quasi-Continuum Method
- Rotation and strain
- Computational chemistry from the perspective of numerical analysis
- Optimal design and relaxation of variational problems, II
- Rank-one convexity does not imply quasiconvexity
- Proposed experimental tests of a theory of fine microstructure and the two-well problem
- Sur la limite thermodynamique pour des modèles de type Hartree et Hartree-Fock
- Thomas-fermi and related theories of atoms and molecules
- A simple model for phase transitions: from the discrete to the continuum problem
- NON-LOCAL VARIATIONAL LIMITS OF DISCRETE SYSTEMS
- Mathematical Analysis of a Bonded Joint with a Soft Thin Adhesive
- Multiscale Problems in Science and Technology
- A General Integral Representation Result for Continuum Limits of Discrete Energies with Superlinear Growth
- Optimisation de géométrie dans le cadre des théories de type Thomas—Fermi pour les cristaux périodiques
- Continuum Limits of Discrete Systems without Convexity Hypotheses
- Theoretical and numerical analysis for the quasi-continuum approximation of a material particle model
- A Definition of the Ground State Energy for Systems Composed of Infinitely Many Particles
- Variational Methods in Nonlinear Elasticity
- Unique Solvability of a System of Nonlinear Elliptic PDEs Arising in Solid State Physics
- From atoms to crystals: a mathematical journey
- HANS BETHE'S CONTRIBUTIONS TO SOLID-STATE PHYSICS
- Analysis of a prototypical multiscale method coupling atomistic and continuum mechanics
- Derivation of Higher Order Gradient Continuum Models from Atomistic Models for Crystalline Solids
- Direct methods in the calculus of variations
- Multiscale and multiresolution methods. Theory and applications
- An analysis of the quasicontinuum method
- On the thermodynamic limit for Hartree-Fock type models
- Thomas-Fermi type theories for polymers and thin films.
- Periodicity of the infinite-volume ground state of a one-dimensional quantum model
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
- Unnamed Item
