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An analysis of the network defined by the potential energy minima of multi-atomic systems and their connectivity via reaction pathways that go through transition states allows to understand important characteristics like thermodynamic,…

材料科学 · 物理学 2016-08-03 Bastian Schaefer , Stefan Goedecker

The vaporization of a freely moving drop in a uniform, high-temperature gas stream is investigated through direct numerical simulation. The incompressible Navier-Stokes equations with surface tension and phase change are solved in…

流体动力学 · 物理学 2023-10-03 Bradley Boyd , Sid Becker , Yue Ling

We develop a robust and versatile platform to define nanostructures at oxide interfaces via patterned top gates. Using LaAlO$_3$/SrTiO$_3$ as a model system, we demonstrate controllable electrostatic confinement of electrons to nanoscale…

介观与纳米尺度物理 · 物理学 2015-04-10 Srijit Goswami , Emre Mulazimoglu , Lieven M. K. Vandersypen , Andrea D. Caviglia

The motion of a gas-liquid interface along a solid wall is influenced by the capillary forces resulting from the interface's shape and its interaction with the solid, where it forms a dynamic contact angle. Capillary models play a…

We exploit the optical lever principle to detect minute fluctuations of a liquid-air interface. Waves propagating on the interface deflect a specularly reflected laser beam, inducing angular deviations captured by a dual-element photodiode.…

Many-body dissipative particle dynamics (MDPD) is a mesoscale method capable of reproducing liquid-vapour coexistence in a single simulation. Despite having been introduced more than a decade ago, this method remains broadly unexplored and,…

化学物理 · 物理学 2019-02-25 Peter Vanya , Phillip Crout , Jonathan Sharman , James A. Elliott

Dynamic mode decomposition (DMD) provides a principled approach to extract physically interpretable spatial modes from time-resolved flow field data, along with a linear model for how the amplitudes of these modes evolve in time. Recently,…

流体动力学 · 物理学 2020-07-29 Aditya G. Nair , Benjamin Strom , Bingni W. Brunton , Steven L. Brunton

We present a novel numerical method to solve the incompressible Navier-Stokes equations for two-phase flows with phase change, using a one-fluid approach. Separate phases are tracked using a geometric Volume-Of-Fluid (VOF) method with…

计算物理 · 物理学 2021-02-03 L. C. Malan , A. G. Malan , S. Zaleski , P. G. Rousseau

Multiphase flows are commonly found in chemical engineering processes such as distillation columns, bubble columns, fluidized beds and heat exchangers. The physical boundaries of domains in numerical simulations of multiphase flows are…

流体动力学 · 物理学 2023-04-21 Tanyakarn Treeratanaphitak , Nasser Mohieddin Abukhdeir

The adsorption dynamics of a colloidal particle at a fluid interface is studied theoretically and numerically, documenting distinctly different relaxation regimes. The adsorption of a perfectly smooth particle is characterized by a fast…

软凝聚态物质 · 物理学 2017-07-18 Carlos E. Colosqui , Jeffrey F. Morris , Joel Koplik

The interface between liquid water and the Pt(111) metal surface is characterized structurally and thermodynamically via reactive molecular dynamics (MD) simulations within the ReaxFF framework. The formation of a distinct buckled adsorbate…

化学物理 · 物理学 2021-03-19 Christoph Karsten Jung , Laura Braunwarth , Andrey Sinyavskiy , Timo Jacob

Understanding heat transfer characteristics of phase change and enhancing thermal energy transport in nanoscale are of great interest in both theoretical and practical applications. In the present study, we investigated the nanoscale…

计算物理 · 物理学 2016-04-11 Li Li , Pengfei Ji , Yuwen Zhang

High velocity impact between crystalline surfaces is important for a range of material phenomena, yet a fundamental understanding of the effect of surface structure, energetics and kinetics on the underlying thermo-mechanical response…

材料科学 · 物理学 2015-10-14 Zhenqi Yang , Sinan Muftu , Moneesh Upmanyu

The state of a sample during crystal growth from high temperature solutions is not accessible in conventional furnace systems. An optimization of the growth parameters often requires arduous trial and error procedures in particular in case…

材料科学 · 物理学 2019-10-02 Andreas G. F. Schneider , Paul Sass , Robert Schöndube , Anton Jesche

Infrared thermography is a powerful tool for studying liquid-to-vapor phase change processes. However, its application has been limited in the study of vapor-to-liquid phase transitions due to the presence of complex liquid dynamics,…

The first order phase transition of a water cluster confined in a dynamic single-walled carbon nanotube is investigated using a classical molecular dynamics (MD) method. The formation of ice-nanotube is monitored through the structure…

材料科学 · 物理学 2007-05-23 Junichiro Shiomi , Tatsuto Kimura , Shigeo Maruyama

Interface localization-delocalization transitions (ILDT) occur in two-phase fluids confined in a slit with competing preferences of the walls for the two fluid phases. At low temperatures the interface between the two phases is localized at…

软凝聚态物质 · 物理学 2019-01-01 Svyatoslav Kondrat , Oleg A. Vasilyev , S. Dietrich

The thermodynamic state of lipid interfaces was observed during shock wave induced cavitation in water with sub-microsecond resolution, using the emission spectra of hydration-sensitive fluorescent probes co-localized at the interface. The…

软凝聚态物质 · 物理学 2019-05-15 Shamit Shrivastava , Robin O. Cleveland

By using a limit analysis for the motion equations of viscous fluid endowed with internal capillarity, we are able to propose a dynamical expression for the surface tension of moving liquid-vapour interfaces without any phenomenological…

数学物理 · 物理学 2013-11-19 Henri Gouin

The Immersed Interface Method is employed to solve the time-varying electric field equations around a three-dimensional vesicle. To achieve second-order accuracy the implicit jump conditions for the electric potential, up to the second…

软凝聚态物质 · 物理学 2015-03-19 Ebrahim M. Kolahdouz , David Salac
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