A nanoscale temperature-dependent heterogeneous nucleation theory

2015 ◽  
Vol 117 (22) ◽  
pp. 224303 ◽  
Author(s):  
Y. Y. Cao ◽  
G. W. Yang
Keyword(s):  
Heterogeneous Nucleation ◽  
Nucleation Theory ◽  
Temperature Dependent

scholarly journals Nucleation Behavior of a Single Al-20Si Particle Rapidly Solidified in a Fast Scanning Calorimeter

Materials ◽  
2021 ◽  
Vol 14 (11) ◽  
pp. 2920
Author(s):  
Qin Peng ◽  
Bin Yang ◽  
Benjamin Milkereit ◽  
Dongmei Liu ◽  
Armin Springer ◽  
...  
Keyword(s):  
Cooling Rate ◽  
Rapid Solidification ◽  
Heterogeneous Nucleation ◽  
Nucleation Theory ◽  
Classical Nucleation Theory ◽  
Solidification Behavior ◽  
Nucleation Kinetics ◽  
Nucleation Behavior ◽  
Nucleation Undercooling ◽  
Primary Si

Understanding the rapid solidification behavior characteristics, nucleation undercooling, and nucleation mechanism is important for modifying the microstructures and properties of metal alloys. In order to investigate the rapid solidification behavior in-situ, accurate measurements of nucleation undercooling and cooling rate are required in most rapid solidification processes, e.g., in additive manufacturing (AM). In this study, differential fast scanning calorimetry (DFSC) was applied to investigate the nucleation kinetics in a single micro-sized Al-20Si (mass%) particle under a controlled cooling rate of 5000 K/s. The nucleation rates of primary Si and secondary α-Al phases were calculated by a statistical analysis of 300 identical melting/solidification experiments. Applying a model based on the classical nucleation theory (CNT) together with available thermodynamic data, two different heterogeneous nucleation mechanisms of primary Si and secondary α-Al were proposed, i.e., surface heterogeneous nucleation for primary Si and interface heterogenous nucleation for secondary α-Al. The present study introduces a practical method for a detailed investigation of rapid solidification behavior of metal particles to distinguish surface and interface nucleation.

scholarly journals An adsorption theory of heterogeneous nucleation of water vapour on nanoparticles

2015 ◽  
Vol 15 (15) ◽  
pp. 21883-21906
Author(s):  
A. Laaksonen ◽  
J. Malila
Keyword(s):  
Water Vapour ◽  
Heterogeneous Nucleation ◽  
Large Scale ◽  
Laboratory Data ◽  
Theoretical Description ◽  
Nucleation Theory ◽  
Cloud Formation ◽  
Scale Model ◽  
Adsorption Theory ◽  
Ice Cloud

Abstract. Heterogeneous nucleation of water vapour on insoluble nuclei is a phenomenon that can induce atmospheric water and ice cloud formation. However, modelling of the phenomenon is hampered by the fact that the predictive capability of the classical heterogeneous nucleation theory is rather poor. A reliable theoretical description of the influence of different types of water-insoluble nuclei in triggering the water condensation or ice deposition would help to decrease uncertainty in large scale model simulations. In this paper we extend a recently formulated adsorption theory of heterogeneous nucleation to be applicable to highly curved surfaces, and test the theory against laboratory data for water vapour nucleation on silica, titanium dioxide and silver oxide nanoparticles. We show that unlike the classical heterogeneous nucleation theory, the new theory is able to quantitatively predict the experimental results.

Molecular Dynamics Simulation of Nano Cluster-Seed Effects on Heterogeneous Nucleation

2009 ◽  
Author(s):  
Donguk Suh ◽  
Seung-chai Jung ◽  
Woong-sup Yoon
Keyword(s):  
Molecular Dynamics ◽  
Heterogeneous Nucleation ◽  
Three Dimensional ◽  
Seed Mass ◽  
Nucleation Theory ◽  
Dynamics Simulation ◽  
Classical Nucleation Theory ◽  
Supersaturation Ratio ◽  
Order Of Magnitude ◽  
Nano Cluster

A three-dimensional heterogeneous nucleation is simulated by classical molecular dynamics, where the Lennard-Jones gas and solid nano cluster-seed molecules have argon and aluminum properties, respectively. All dimensions of the wall are periodic and a soft core carrier gas within the system controls the temperature rise induced by latent heat of condensation. There are three shapes of cluster-seeds being cube, rod, and sphere, three classes of masses, and the simulation took place under nine supersaturation ratios, making a total of 81 calculations. An analysis of variance was performed under a three-way layout to analyze the cluster-seed and supersaturation ratio effects on the system. For supersaturation ratios above the critical value nucleation rates were evaluated, below growth rates, and overall liquefaction rates were each defined and calculated. Results show that the supersaturation ratio dominantly controls all rates, but seed characteristics are important for the growth of the largest cluster under the critical supersaturation ratio. Overall liquefaction increases subject to an escalation of supersaturation ratio and seed mass. However, the significance of the supersaturation ratio for overall liquefaction suggests that thermal diffusion is more dominant than mass interactions for this system. Homogeneous characteristics are also compared with the heterogeneous system to find that though nucleation may occur for an insufficient supersaturation ratio when a seed is within the system, the addition of a seed does not in fact facilitate the increase in rates of the phenomena at high supersaturation ratios. Finally a comparison with the classical nucleation theory asserts a 3 to 4 order of magnitude difference, which is within the lines of deviation when it comes to theory and molecular simulations.

Solidification Modeling of Bulk Amorphous Alloys

2003 ◽  
Vol 806 ◽  
Author(s):  
Sang Bok Lee ◽  
Nack J. Kim
Keyword(s):  
Heterogeneous Nucleation ◽  
Amorphous Alloys ◽  
Nucleation Theory ◽  
Cooling Rates ◽  
Continuous Cooling ◽  
Wide Range ◽  
Temperature Transformation ◽  
Transformation Diagrams ◽  
Experimental Values ◽  
Kinetics Of

ABSTRACTClassical heterogeneous nucleation theory coupled with DTA data has been used to closely estimate the crystallization behavior of continuously cooled bulk metallic glass (BMG) alloys. Continuous cooling transformation and time temperature transformation diagrams of three BMG alloys, Zr41.2Ti13.8Cu12.5Ni10Be22.5, Cu47Ti33Zr11Ni6Si1Sn2 and Mg65Cu25Y10 alloys, have been calculated. The critical cooling rates Rc of three alloys were calculated to be 1.7 K/s, 242 K/s and 36 K/s for Zr41.2Ti13.8Cu12.5Ni10Be22.5, Cu47Ti33Zr11Ni6Si1Sn2 and of Mg65Cu25Y10 alloys, respectively, which match well with the experimental values. We conclude that heterogeneous nucleation is more favorable than homogeneous nucleation for the formation of crystals during cooling of BMG alloy liquids. Our approach can be applied to the analyses of crystallization kinetics of BMG alloys with a wide range of critical cooling rates during continuous cooling as well as isothermal annealing.

scholarly journals An adsorption theory of heterogeneous nucleation of water vapour on nanoparticles

2016 ◽  
Vol 16 (1) ◽  
pp. 135-143 ◽  
Author(s):  
A. Laaksonen ◽  
J. Malila
Keyword(s):  
Water Vapour ◽  
Heterogeneous Nucleation ◽  
Large Scale ◽  
Laboratory Data ◽  
Theoretical Description ◽  
Nucleation Theory ◽  
Cloud Formation ◽  
Scale Model ◽  
Adsorption Theory ◽  
Ice Cloud

Abstract. Heterogeneous nucleation of water vapour on insoluble nuclei is a phenomenon that can induce atmospheric water and ice cloud formation. However, modelling of the phenomenon is hampered by the fact that the predictive capability of the classical heterogeneous nucleation theory is rather poor. A reliable theoretical description of the influence of different types of water-insoluble nuclei in triggering the water condensation or ice deposition would help to decrease uncertainty in large-scale model simulations. In this paper we extend a recently formulated adsorption theory of heterogeneous nucleation to be applicable to highly curved surfaces, and test the theory against laboratory data for water vapour nucleation on silica, titanium dioxide and silver oxide nanoparticles. We show that unlike the classical heterogeneous nucleation theory, the new theory is able to quantitatively predict the experimental results.

Heterogeneous nucleation theory revisited: Effect of triple junction line energy

2016 ◽  
Vol 174 ◽  
pp. 180-183 ◽  
Author(s):  
R.G. Faulkner ◽  
L.S. Shvindlerman ◽  
Y. Yin
Keyword(s):  
Heterogeneous Nucleation ◽  
Triple Junction ◽  
Nucleation Theory ◽  
Line Energy
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