Phase-field model of stoichiometric compounds and solution phases

Phase-field modeling of microstructure evolution: Recent applications, perspectives and challenges

(2021) Damien Tourret et al.   PROGRESS IN MATERIALS SCIENCE

Atomic structures of interfacial solute gateways to θ′ precipitates in Al-Cu alloys

(2021) M.F. Chisholm et al.   ACTA MATERIALIA

From Classical Thermodynamics to Phase-field Method

(2021) Long-Qing Chen et al.   PROGRESS IN MATERIALS SCIENCE

Thermodynamic models of multicomponent nonstoichiometric solution phases using internal process order parameters

(2021) Yanzhou Ji et al.   ACTA MATERIALIA

Prediction of the Al-rich part of the Al-Cu phase diagram using cluster expansion and statistical mechanics

(2020) S. Liu et al.   ACTA MATERIALIA

Multiscale modelling of precipitation hardening in Al–Cu alloys: Dislocation dynamics simulations and experimental validation

(2020) R. Santos-Güemes et al.   ACTA MATERIALIA

The growth mechanisms of θ′ precipitate phase in an Al-Cu alloy during aging treatment

(2020) Lin Gao et al.   JOURNAL OF MATERIALS SCIENCE & TECHNOLOGY

Study of θ’ precipitation behavior in Al-Cu-Cd alloys by phase-field modeling

(2019) Yisen Hu et al.   MATERIALS SCIENCE AND ENGINEERING A-STRUCTURAL MATERIALS PROPERTIES MICROSTRUCTURE AND PROCESSING

Phase-field modeling of crystal nucleation in undercooled liquids – A review

(2019) László Gránásy et al.   PROGRESS IN MATERIALS SCIENCE

Chemical potential and Gibbs free energy

(2019) Long-Qing Chen   MRS BULLETIN

Elevated temperature microstructural stability in cast AlCuMnZr alloys through solute segregation

(2019) A. Shyam et al.   MATERIALS SCIENCE AND ENGINEERING A-STRUCTURAL MATERIALS PROPERTIES MICROSTRUCTURE AND PROCESSING

Recent developments in the Inorganic Crystal Structure Database: theoretical crystal structure data and related features

(2019) D. Zagorac et al.   JOURNAL OF APPLIED CRYSTALLOGRAPHY

Phase-field modeling of θ′ precipitation kinetics in 319 aluminum alloys

(2018) Yanzhou Ji et al.   COMPUTATIONAL MATERIALS SCIENCE

Discrete dislocation dynamics simulations of dislocation- θ ′ precipitate interaction in Al-Cu alloys

(2018) R. Santos-Güemes et al.   JOURNAL OF THE MECHANICS AND PHYSICS OF SOLIDS

Review on modeling of the anode solid electrolyte interphase (SEI) for lithium-ion batteries

(2018) Aiping Wang et al.   npj Computational Materials

Temporal evolution of coherent precipitates in an aluminum alloy W319: A correlative anisotropic small angle X-ray scattering, transmission electron microscopy and atom-probe tomography study

(2016) Aniruddha Biswas et al.   ACTA MATERIALIA

Modulation of dendritic patterns during electrodeposition: A nonlinear phase-field model

(2015) Lei Chen et al.   JOURNAL OF POWER SOURCES

The Open Quantum Materials Database (OQMD): assessing the accuracy of DFT formation energies

(2015) Scott Kirklin et al.   npj Computational Materials

Predicting β′ precipitate morphology and evolution in Mg–RE alloys using a combination of first-principles calculations and phase-field modeling

(2014) Y.Z. Ji et al.   ACTA MATERIALIA

Phase-Field Model for Microstructure Evolution at the Mesoscopic Scale

(2013) Ingo Steinbach   Annual Review of Materials Research

Efficient Atomic-Scale Kinetics through a Complex Heterophase Interface

(2013) Laure Bourgeois et al.   PHYSICAL REVIEW LETTERS

Commentary: The Materials Project: A materials genome approach to accelerating materials innovation

(2013) Anubhav Jain et al.   APL Materials

AFLOW: An automatic framework for high-throughput materials discovery

(2012) Stefano Curtarolo et al.   COMPUTATIONAL MATERIALS SCIENCE

Nonlinear phase-field model for electrode-electrolyte interface evolution

(2012) Linyun Liang et al.   PHYSICAL REVIEW E

Structure and energetics of the coherent interface between the θ′ precipitate phase and aluminium in Al–Cu

(2011) Laure Bourgeois et al.   ACTA MATERIALIA

Precipitates in Al–Cu alloys revisited: Atom-probe tomographic experiments and first-principles calculations of compositional evolution and interfacial segregation

(2011) Aniruddha Biswas et al.   ACTA MATERIALIA

Phase field modeling of defects and deformation

(2009) Yunzhi Wang et al.   ACTA MATERIALIA

An introduction to phase-field modeling of microstructure evolution

(2007) Nele Moelans et al.   CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY