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Metastable alloys, such as $\beta$-phase titanium (Ti) alloys with a body-centered cubic (BCC) lattice, can exhibit exceptional mechanical properties through the interplay of multiple deformation mechanisms -- diffusionless phase…

Materials Science · Physics 2025-10-16 Ganlin Chen , Deepak V Pillai , Yufeng Zheng , Liang Qi

We develop a thermodynamically consistent chemo-thermo-mechanical model for the $\beta\rightarrow\delta$ phase transition of energetic HMX crystals. In contrast to previous models, which either considered specific heat to be a constant or…

Chemical Physics · Physics 2023-01-13 C. W. Williams , K. Matous

The geometrical approach to phase transitions is illustrated by simulating the high-temperature representation of the Ising model on a square lattice.

Statistical Mechanics · Physics 2009-11-10 Wolfhard Janke , Adriaan M. J. Schakel

Within the framework of mean field theory, we examine the phase transitions in Ising magnetic films and superlattices. By transfer matrix method, we derive two general nonlinear equations for phase transition temperatures of Ising magnetic…

Materials Science · Physics 2009-10-31 Xiao-Guang Wang , Shao-Hua Pan , Guo-Zhen Yang

We study the response of a thermal state of an Ising chain to a nonlocal non-Hermitian perturbation, which coalesces the topological Kramer-like degeneracy in the ferromagnetic phase. The dynamic responses for initial thermal states in…

Strongly Correlated Electrons · Physics 2021-03-24 K. L. Zhang , Z. Song

Zirconium (Zr) is an important engineering material with numerous practical applications. It undergoes martensitic $\alpha$ to $\omega$ phase transformation (PT) at pressures that vary from 0.67 GPa to 17 GPa under different loading…

Materials Science · Physics 2025-05-15 Raghunandan Pratoori , Hamed Babaei , Valery I. Levitas

We present a non-isothermal mesoscopic model for investigation of the phase transition dynamics of thermoresponsive polymers. Since this model conserves energy in the simulations, it is able to correctly capture not only the transient…

Chemical Physics · Physics 2015-04-28 Zhen Li , Yu-Hang Tang , Xuejin Li , George Em Karniadakis

In this work we present an experimental study of structure and phase stability in ternary Cu-Sn-In alloys around 55 at.% Cu in the temperature range 100^{\circ}C < T < 550^{\circ}C. We have followed in real-time the sequence of phase…

Materials Science · Physics 2015-06-05 G. Aurelio , S. A. Sommadossi , G. J. Cuello

The equilibration of sinusoidally modulated distribution of the kinetic temperature is analyzed in the $\beta$-Fermi-Pasta-Ulam-Tsingou chain with different degrees of nonlinearity and for different wavelengths of temperature modulation.…

In a system of interacting thin rigid rods of equal length $2 \ell$ on a two-dimensional grid of lattice spacing $a$, we show that there are multiple phase transitions as the coupling strength $\kappa=\ell/a$ and the temperature are varied.…

Statistical Mechanics · Physics 2022-11-23 Juliane U. Klamser , Tridib Sadhu , Deepak Dhar

In this paper, we derive a thermodynamically consistent non-isothermal diffuse interface model for phase transition and interface evolution involving heat transfer. This model is constructed by integrating concepts from classical…

Analysis of PDEs · Mathematics 2025-08-05 Chun Liu , Jan-Eric Sulzbach , Yiwei Wang

By using frustration-preserving hard-spin mean-field theory, we investigated the phase transition dynamics in the three-dimensional field-free $\pm J$ Ising spin glass model. As the temperature $T$ is decreased from paramagnetic phase at…

Statistical Mechanics · Physics 2021-09-29 Ozan S. Sarıyer

The design of next generation \beta-type titanium implants requires detailed knowledge of the relevant stable and metastable phases at temperatures where metallurgical heat treatments can be performed. Recently, a standard specification for…

Materials Science · Physics 2017-07-26 S. Barzilai , C. Toher , S. Curtarolo , O. Levy

Electrochemical kinetics at electrode-electrolyte interfaces are crucial to understand high-rate behavior of energy storage devices. Phase transformation of electrodes is typically treated under equilibrium thermodynamic conditions, while…

Materials Science · Physics 2022-12-15 Rachel C. Kurchin , Dhairya Gandhi , Venkatasubramanian Viswanathan

Solid-solid phase transitions are ubiquitous in nature, but the kinetic pathway of anisotropic particle systems remains elusive, where the coupling between translational and rotational motions plays a critical role in various kinetic…

Soft Condensed Matter · Physics 2026-01-30 Ruijian Zhu , Yi Peng , Yanting Wang

Available simulation methods, suitable to describe solid-solid phase transitions occurring upon increasing of presssure and/or temperature, are based on empirical interatomic potentials: this restriction reduces the predictive power, and…

Condensed Matter · Physics 2016-08-31 P. Focher , G. L. Chiarotti , M. Bernasconi , E. Tosatti , M. Parrinello

We overview the concept of dynamical phase transitions in isolated quantum systems quenched out of equilibrium. We focus on non-equilibrium transitions characterized by an order parameter, which features qualitatively distinct temporal…

Statistical Mechanics · Physics 2022-10-25 Jamir Marino , Martin Eckstein , Matthew S. Foster , Ana Maria Rey

The temperature-induced orthorhombic to cubic phase transition in Li2C2 is a prototypical example of a solid to solid phase transformation between an ordered phase, which is well described within the phonon theory, and a dynamically…

Materials Science · Physics 2023-04-14 Johan Klarbring , Stanislav Filippov , Ulrich Häussermann , Sergei I. Simak

First-order phase transition in a highly correlated electron system can manifest as a dynamic phenomenon. The presence of multiple domains of the coexisting phases average out the dynamical effects making it nearly impossible to predict the…

Mesoscale and Nanoscale Physics · Physics 2014-09-17 Devendra Kumar , K. P. Rajeev , J. A. Alonso , M. J. Martínez-Lope

Nonequilibrium steady state of isothermal biochemical cycle kinetics has been extensively studied, but much less investigated under non-isothermal conditions. However, once the heat exchange between subsystems is rather slow, the isothermal…

Chemical Physics · Physics 2016-10-11 Xiao Jin , Hao Ge