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In this work, we present an efficient framework that combines machine learning potential (MLP) and metadynamics to explore multi-dimensional free energy surfaces for investigating solid-solid phase transition. Based on the spectral…
Bubble nucleation at catalyst surfaces plays a critical role in the operation of electrolyzers. However, achieving controlled bubble nucleation remains challenging due to limited understanding of the underlying mechanisms. Here, we present…
The interfacial free energy is a central quantity in crystallization from the meta-stable melt. In suspensions of charged colloidal spheres, nucleation and growth kinetics can be accurately measured from optical experiments. In previous…
Studies of nucleation generally focus on the properties of the critical cluster, but the presence of defects within the crystal lattice means that the population of nuclei necessarily evolve through a distribution of pre-critical clusters…
A chiral supersolid is a quantum phase that simultaneously exhibits crystalline order, superfluidity, and topological spin texture, with spontaneously broken translational, U(1) gauge, and chiral symmetries. Here, we demonstrate a chiral…
In this paper, a Freedericksz-like positional transition is found for a spherical micro-droplet suspended in a nematic liquid crystal cell in the presence of an external electric field. Based on the numerical calculation of elastic energy…
In simulations of supercooled, high-density liquid silica we study a range of temperature T in which we find both crystal nucleation, as well as the characteristic dynamics of a glass forming liquid, including a breakdown of the…
We consider a system of spherical particles interacting by means of a pair potential equal to a finite constant for interparticle distances smaller than the sphere diameter and zero outside. The model may be a prototype for the interaction…
We found that thermodynamic quantum time crystals in fermi systems, defined as quantum orders oscillating periodically in the imaginary Matsubara time with zero mean, are metastable for two general classes of solutions. Mean-field time…
We present experimental evidence for a first-order freezing/melting phase transition in a nonequilibrium system -- an oscillated two-dimensional isobaric granular fluid. The steady-state transition occurs between a gas and a crystal and is…
The ground state of a two-dimensional, harmonically confined mesoscopic assembly of up to thirty polar molecules is studied by computer simulations. As the strength of the confining trap is increased, clusters evolve from superfluid, to…
The phase diagram of model anisotropic particles with four attractive patches in a tetrahedral arrangement has been computed at two different values for the range of the potential, with the aim of investigating the conditions under which a…
Models of spin glasses are studied with a phase transition discontinuous in the Parisi order parameter. It is assumed that the leading order corrections to the thermodynamic limit of the high temperature free energy are due to the existence…
In this thesis we investigate the instabilities of superfluids at finite superflow by means of a hydrodynamical approach. We find that at a finite value of the background superfluid velocity a hydrodynamic collective mode crosses to the…
In this work, a theoretical study of phase equilibrium in mixtures of a calamitic nematic liquid crystal and hard spherical nanoparticles is presented. A mean-field thermodynamic model is used, where the interactions are considered to be…
In standard nucleation theory, the nucleation process is characterized by computing $\Delta\Omega(V)$, the reversible work required to form a cluster of volume $V$ of the stable phase inside the metastable mother phase. However, other…
This paper is mainly concerned with the free boundary problem for an approximate model (for example, arising from the study of sonoluminescence) of a gas bubble of finite mass enclosed within a bounded incompressible viscous liquid,…
A system of a metastable phase with several sorts of heterogeneous centers is considered. An analytical theory for the process of decay in such a system has been constructed. The free energy of formation of a critical embryo is assumed to…
Using hydrodynamic approach, it is shown that the properties of a marginally stable collisionless stellar disc resemble those of a thermodynamic system undergoing a gas--liquid phase transition. The maximum in Toomre's stability diagram,…
We investigate the phase behavior of a single-component system in 3 dimensions with spherically-symmetric, pairwise-additive, soft-core interactions with an attractive well at a long distance, a repulsive soft-core shoulder at an…