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  1. Phase Field

    In the formulation of the diffuse interfaceInterfacediffuse (Sect.  1.2 ), the order parameter...
    Chapter 2024
  2. Quantum Phase Field

    In this chapter a new paradigm for the understanding of the physical world is developed based on phase-field type non-linear wave solutions. Two...
    Ingo Steinbach, Hesham Salama in Lectures on Phase Field
    Chapter Open access 2023
  3. Blue Phase Liquid Crystals

    Investigation of chirality in liquid crystals is an exciting area of science of mesophases. Many frustrated phases are induced by chirality including...
    Chapter 2024
  4. The Bell-Evans-Polanyi relation for hydrogen evolution reaction from first-principles

    The versatile Bell-Evans-Polanyi (BEP) relation stipulates the kinetics of a reaction in terms of thermodynamics. Herein, we establish the BEP...

    Timothy T. Yang, Wissam A. Saidi in npj Computational Materials
    Article Open access 08 May 2024
  5. Reentrant Phase Transitions in Liquid Crystals

    Phenomenon of reentrancy of a low symmetry (high order) phase in-between two high symmetry (low order) phases as the transition thermodynamic...
    Chapter 2024
  6. A merging constitutive relation for skins under uniaxial tension

    Mechanical tests for various skins showed that the experimental stress–strain curves under uniaxial tension are composed of two regimes with...

    X. L. Ji, H. H. Zhang, S. Y. Han in MRS Communications
    Article 01 June 2023
  7. Breakdown of the Nernst–Einstein relation in carbon nanotube porins

    For over 100 years, the Nernst–Einstein relation has linked a charged particle’s electrophoretic mobility and diffusion coefficient. Here we report...

    Zhongwu Li, Rahul Prasanna Misra, ... Aleksandr Noy in Nature Nanotechnology
    Article 30 December 2022
  8. Supercooling of the Liquid Phase. General Aspects

    From the point of view of thermodynamics, the stable phase is the phase that has a minimum of free energy. Thus, the phase transition temperature...
    Serhii Dukarov, Serhii Petrushenko, ... Vladimir Sukhov in Formation and Temperature Stability of the Liquid Phase in Thin-Film Systems
    Chapter 2024
  9. EDS-PhaSe: Phase Segmentation and Analysis from EDS Elemental Map Images Using Markers of Elemental Segregation

    Scanning electron microscopy (SEM), combined with energy-dispersive spectroscopy (EDS), is an extensively used technique for in-depth microstructural...

    Dishant Beniwal, Vikas Shivam, ... Pratik K. Ray in Metallography, Microstructure, and Analysis
    Article 20 November 2023
  10. Phase Transitions in Layered Film Systems

    In addition to measuring the crystallization temperatures of supercooled melts, supercooling studies suppose obtaining information on the kinetics of...
    Serhii Dukarov, Serhii Petrushenko, ... Vladimir Sukhov in Formation and Temperature Stability of the Liquid Phase in Thin-Film Systems
    Chapter 2024
  11. Computer Simulations of Phase Transitions in Liquid Crystals

    Computer simulation experiments have played a key role in develo** understanding on the structure and properties, and other aspects of liquid...
    Chapter 2024
  12. Phase Transformations

    A fundamental criterion for the thermodynamic stability of solid solutions and compounds is the density of electron states, DOS, at the Fermi level,...
    V. G. Gavriljuk, V. M. Shyvaniuk, S. M. Teus in Hydrogen in Engineering Metallic Materials
    Chapter 2022
  13. Quantum Hall phase in graphene engineered by interfacial charge coupling

    The quantum Hall effect can be substantially affected by interfacial coupling between the host two-dimensional electron gases and the substrate, and...

    Yaning Wang, **ang Gao, ... Zhidong Zhang in Nature Nanotechnology
    Article Open access 21 November 2022
  14. Adaptable “bubble particles” prepared by green aqueous phase resha** for completely removing odor

    Facile and ecofriendly loading of micro/nano function-specific substances to create functional materials is a trend being pursued by researchers....

    Jiajia Ma, Yichang **a, ... Yi Zhao in Nano Research
    Article 09 August 2023
  15. Symmetry relation database and its application to ferroelectric materials discovery

    To investigate the displacive phase transition at the atomic scale, we have implemented a numerical algorithm to automate the detection of the...

    Qiang Zhu, Byungkyun Kang, Kevin Parrish in MRS Communications
    Article 30 September 2022
  16. Phase-field method of materials microstructures and properties

    The phase-field method has become the main computational technique for modeling and predicting the microstructure evolution in materials science and...

    Long-Qing Chen, Nele Moelans in MRS Bulletin
    Article 03 June 2024
  17. The Calculation of Free-Energiesin Semiconductors: Defects, Transitionsand Phase Diagrams

    In this chapter we review a series of novel techniques that make possible the efficient calculation of free energies in condensed-matter systems,...
    E. R. Hernández, A. Antonelli, ... P. Ordejón in Theory of Defects in Semiconductors
    Chapter
  18. Design of new-concept magnetomechanical devices by phase-field simulations

    The phase-field method enables simulating the spatiotemporal evolution of the coupled physical-order parameters under externally applied fields in a...

    Jia-Mian Hu in MRS Bulletin
    Article 29 April 2024
  19. Unequally and Non-linearly Weighted Averaging Operators as a General Homogenization Approach for Phase Field Modeling of Phase Transforming Materials

    The phase field method has been shown to have tremendous potential to serve as a continuum modeling approach of microstructural evolution mechanisms...

    V. von Oertzen, B. Kiefer in Shape Memory and Superelasticity
    Article Open access 30 November 2022
  20. Elasto-plastic residual stress analysis of selective laser sintered porous materials based on 3D-multilayer thermo-structural phase-field simulations

    Residual stress and plastic strain in additive manufactured materials can exhibit significant microscopic variation at the powder scale, profoundly...

    Yangyiwei Yang, Somnath Bharech, ... Bai-**ang Xu in npj Computational Materials
    Article Open access 30 May 2024
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