An extended molecular statics algorithm simulating the electromechanical continuum response of ferroelectric materials

DOI10.1007/S00466-014-1072-7zbMATH Open1309.74027OpenAlexW1977985836MaRDI QIDQ487885FDOQ487885

Authors: F. Endres, Paul Steinmann 

Publication date: 23 January 2015

Published in: Computational Mechanics (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1007/s00466-014-1072-7

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zbMATH Keywords

ferroelectric materialmolecular staticsbarium titanatecore-shell modelferroelectric hysteresis

Mathematics Subject Classification ID

Molecular, statistical, and kinetic theories in solid mechanics (74A25) Electromagnetic effects in solid mechanics (74F15) Problems involving hysteresis in solids (74N30)

Cites Work

• Continuum thermodynamics of ferroelectric domain evolution: theory, finite element implementation, and application to domain wall pinning
• On the Cauchy—Born Rule
• Title not available (Why is that?)
• On higher gradients in continuum-atomistic modelling.
• A constitutive model for ferroelectric polycrystals
• Modeling materials. Continuum, atomistic and multiscale techniques.
• Nichtlineare Finite-Element-Methoden
• Ferroelectric and ferroelastic piezoceramics -- modeling of electromechanical hysteresis phenomena.
• On (Andersen-)Parrinello-Rahman molecular dynamics, the related metadynamics, and the use of the Cauchy-Born rule
• On the physical interpretation of material parameters in phase field models for ferroelectrics
• Comparison of several staggered atomistic-to-continuum concurrent coupling strategies
• Computational modeling of domain wall interactions with dislocations in ferroelectric crystals

Cited In (1)

• Molecular statics simulations of ferroelectric barium titanate in the rhombohedral phase

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