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We present and discuss the development of an unconditionally stable algorithm used to solve the evolution equations of the Phase Field Crystal (PFC) model. This algorithm allows for an arbitrarily large algorithmic time step. As the basis…

Computational Physics · Physics 2009-11-13 Mowei Cheng , James A. Warren

This paper presents an overview of the theories and computer implementation aspects of phase field models (PFM) of fracture. The advantage of PFM over discontinuous approaches to fracture is that PFM can elegantly simulate complicated…

Geophysics · Physics 2023-09-11 X. Zhuang , S. Zhou , G. D. Huynh , P. Areias , T. Rabczuk

In this journal, we study the phase-field model of solidification for numerical simulation of dendritic crystal growth that occurs during the casting of metals and alloys based on the kobayashi [1] model. Qualitative relationships between…

Numerical Analysis · Mathematics 2014-12-11 Rahul Sanal

Phase field crystal (PFC) theory, extensively used for modelling the structure of solids, can be derived from dynamical density functional theory (DDFT) via a sequence of approximations. Standard derivations neglect a term of form…

Soft Condensed Matter · Physics 2019-09-04 Andrew J. Archer , Daniel J. Ratliff , Alastair M. Rucklidge , Priya Subramanian

We investigate the potential of quasi-Newton methods in facilitating convergence of monolithic solution schemes for phase field fracture modelling. Several paradigmatic boundary value problems are addressed, spanning the fields of…

Numerical Analysis · Mathematics 2019-12-19 Philip K. Kristensen , Emilio Martínez-Pañeda

This paper contrasts recursive state space models and direct multi-step predictors for linear predictive control. We provide a tutorial exposition for both model structures to solve the following problems: 1. stochastic optimal control; 2.…

Optimization and Control · Mathematics 2023-10-09 Johannes Köhler , Kim P. Wabersich , Julian Berberich , Melanie N. Zeilinger

This paper is devoted to the robust approximation with a variational phase field approach of multiphase mean curvature flows with possibly highly contrasted mobilities. The case of harmonically additive mobilities has been addressed…

Numerical Analysis · Mathematics 2022-09-20 Eric Bonnetier , Elie Bretin , Simon Masnou

We perform a systematic comparison of various numerical schemes for the approximation of interface problems. We consider unfitted approaches in view of their application to possibly moving configurations. Particular attention is paid to the…

Numerical Analysis · Mathematics 2023-04-25 Daniele Boffi , Andrea Cangiani , Marco Feder , Lucia Gastaldi , Luca Heltai

In this paper the relationship between the density functional theory of freezing and phase field modeling is examined. More specifically a connection is made between the correlation functions that enter density functional theory and the…

Materials Science · Physics 2007-05-23 K. R. Elder , Nikolas Provatas , Joel Berry , Peter Stefanovic , Martin Grant

Crystalline defects critically influence material properties, necessitating accurate simulation methods. Existing approaches, from atomic-scale configurations to continuum elasticity, face inherent limitations in modeling…

Materials Science · Physics 2025-10-09 Xinyi Wei , Yangshuai Wang , Kai Jiang , Lei Zhang

A nonlocal phase-field crystal (NPFC) model is presented as a nonlocal counterpart of the local phase-field crystal (LPFC) model and a special case of the structural PFC (XPFC) derived from classical field theory for crystal growth and…

Numerical Analysis · Mathematics 2026-05-20 Qiang Du , Kai Wang , Jiang Yang

In this paper we focus on the finite-dimensional approximation of quasi-static evolutions of critical points of the phase-field model of brittle fracture. In a space discretized setting, we first discuss an alternating minimization scheme…

Numerical Analysis · Mathematics 2019-03-07 Stefano Almi , Sandro Belz

This work overviews a new, recent success of phase-field modelling: its application to predicting the evolution of the corrosion front and the associated structural integrity challenges. Despite its important implications for society,…

Chemical Physics · Physics 2024-06-24 E. Martínez-Pañeda

As opposed to the distributed control of parabolic PDE's, very few contributions currently exist pertaining to the Dirichlet boundary condition control for parabolic PDE's. This motivates our interest in the Dirichlet boundary condition…

Optimization and Control · Mathematics 2023-08-08 Aleš Wodecki , Pavel Strachota , Tomáš Oberhuber , Kateřina Škardová , Monika Balázsová

Modeling phase change problems numerically is vital for understanding many natural (e.g., ice formation, steam generation) and engineering processes (e.g., casting, welding, additive manufacturing). Almost all phase change materials (PCMs)…

Fluid Dynamics · Physics 2023-09-18 Ramakrishnan Thirumalaisamy , Amneet Pal Singh Bhalla

Fracture is a fundamental mechanism of materials failure. Propagating cracks can exhibit a rich dynamical behavior controlled by a subtle interplay between microscopic failure processes in the crack tip region and macroscopic elasticity. We…

Materials Science · Physics 2015-05-18 R. Spatschek , E. Brener , A. Karma

In this paper we consider a one-dimensional one-phase Stefan problem corresponding to the solidification process of a semi-infinite material with a convective boundary condition at the fixed face. The exact solution of this problem,…

Analysis of PDEs · Mathematics 2018-08-09 Julieta Bollati , José A. Semitiel , Domingo A. Tarzia

A multiscale scheme combining molecular dynamics (MD) and microscopic phase-field theory is proposed to study the structural phase transformations in solids with inhomogeneous strain field. The approach calculates strain response based on…

Materials Science · Physics 2007-05-23 Zhi-Rong Liu , Huajian Gao

The aim of this note is to review some recent developments on the regularity theory for the stationary and parabolic obstacle problems. After a general overview, we present some recent results on the structure of singular free boundary…

Analysis of PDEs · Mathematics 2018-09-24 Alessio Figalli

We investigate the multi-order parameter phase field model of Steinbach and Pezzolla [I. Steinbach, F. Pezzolla, A generalized field method for multiphase transformations using interface fields, Physica D 134 (1999) 385-393] concerning its…

Materials Science · Physics 2015-06-19 V. Sai Pavan Kumar Bhogireddy , C. Hüter , J. Neugebauer , I. Steinbach , A. Karma , R. Spatschek