Homogeneous Bubble Nucleation Predicted by a Molecular Interaction Model

1991 ◽  
Vol 113 (3) ◽  
pp. 714-721 ◽  
Author(s):  
Ho-Young Kwak ◽  
Sangbum Lee

The homogeneous bubble nucleation of various hydrocarbons was estimated by the modified classical nucleation theory. In this modification, the kinetic formalism of the classical theory is retained while the surface energy needed for the bubble formation is calculated from the interaction energy between molecules. With a nucleation rate value of Jnc =1022 nuclei/cm3s, this modified model gives a very good prediction of the superheat limit of liquids. In another test of the model the complete evaporation time of a butane droplet at its superheat limit is compared with experiments and found to be in good agreement.

1999 ◽  
Vol 121 (1) ◽  
pp. 220-225 ◽  
Author(s):  
S.-D. Oh ◽  
S. S. Seung ◽  
H. Y. Kwak

The bubble nucleation mechanism on a cavity-free micro line heater surface was studied by using the molecular cluster model. A finite difference numerical scheme for the three-dimensional transient conduction equation for the liquid was employed to estimate the superheated volume where homogeneous bubble nucleation could occur due to heat diffusion from the heater to the liquid. Calculation results revealed that bubble formation on the heater is possible when the temperature at the hottest point in the heater is greater than the superheat limit of the liquid by 6°C–12°C, which is in agreement with the experimental results. Also it was found that the classical bubble nucleation theory breaks down near the critical point where the radius of the critical bubble is below 100 nm.


Author(s):  
Xi Xi ◽  
Hong Liu ◽  
Chang Cai ◽  
Ming Jia ◽  
Weilong Zhang

Abstract The work attempts to analyze the performance of homogeneous nucleation by using the non-equilibrium thermodynamics theory and the classical nucleation theory. A nucleation rate graph was constructed under a wide range of operating temperature conditions. The results indicate that the superheat limit temperature (SLT) estimated by the modified homogeneous nucleation sub-model is in good agreement with the experimental results. The nucleation rate increases exponentially with the liquid temperature rise when the liquid temperature exceeds the SLT under atmospheric pressure. The superheated temperature needed to trigger the bubble nucleation decreases with the elevated ambient pressure.


2007 ◽  
Vol 7 (19) ◽  
pp. 5081-5091 ◽  
Author(s):  
C. Marcolli ◽  
S. Gedamke ◽  
T. Peter ◽  
B. Zobrist

Abstract. A differential scanning calorimeter (DSC) was used to explore heterogeneous ice nucleation of emulsified aqueous suspensions of two Arizona test dust (ATD) samples with particle diameters of nominally 0–3 and 0–7 μm, respectively. Aqueous suspensions with ATD concentrations of 0.01–20 wt% have been investigated. The DSC thermograms exhibit a homogeneous and a heterogeneous freezing peak whose intensity ratios vary with the ATD concentration in the aqueous suspensions. Homogeneous freezing temperatures are in good agreement with recent measurements by other techniques. Depending on ATD concentration, heterogeneous ice nucleation occurred at temperatures as high as 256 K or down to the onset of homogeneous ice nucleation (237 K). For ATD-induced ice formation Classical Nucleation Theory (CNT) offers a suitable framework to parameterize nucleation rates as a function of temperature, experimentally determined ATD size, and emulsion droplet volume distributions. The latter two quantities serve to estimate the total heterogeneous surface area present in a droplet, whereas the suitability of an individual heterogeneous site to trigger nucleation is described by the compatibility function (or contact angle) in CNT. The intensity ratio of homogeneous to heterogeneous freezing peaks is in good agreement with the assumption that the ATD particles are randomly distributed amongst the emulsion droplets. The observed dependence of the heterogeneous freezing temperatures on ATD concentrations cannot be described by assuming a constant contact angle for all ATD particles, but requires the ice nucleation efficiency of ATD particles to be (log)normally distributed amongst the particles. Best quantitative agreement is reached when explicitly assuming that high-compatibility sites are rare and that therefore larger particles have on average more and better active sites than smaller ones. This analysis suggests that a particle has to have a diameter of at least 0.1 μm to exhibit on average one active site.


Author(s):  
W J Cho ◽  
H Park ◽  
J R Youn

Ultrasonic foam processing of polyurethane for reaction injection moulding (RIM) was studied experimentally to investigate feasibility of ultrasonic bubble nucleation in polyurethane. Bubble nucleation was also studied theoretically to predict the rate of nucleation. Classical nucleation theory and cluster theory have been employed for explanation of the nucleation phenomena. A polyol resin was saturated with nitrogen at various pressures and the pressure was released slowly in order to generate supersaturated resin. Other components of the selected polyurethane system were added to the supersaturated resin and ultrasonic disruption was applied to the system producing enhanced nucleation. The ultrasonic excitation created a good foam structure even at a low saturation pressure around 0.15 MPa (1.5 atm). The effect of the ultrasonic activation on the bubble nucleation was considered and included in the nucleation theories. The cluster nucleation theory along with consideration of the ultrasonic effect predicted a higher rate of nucleation than the classical nucleation theory for the same condition.


2018 ◽  
Vol 115 (21) ◽  
pp. 5348-5352 ◽  
Author(s):  
Haiyang Niu ◽  
Pablo M. Piaggi ◽  
Michele Invernizzi ◽  
Michele Parrinello

Silica is one of the most abundant minerals on Earth and is widely used in many fields. Investigating the crystallization of liquid silica by atomic simulations is of great importance to understand the crystallization mechanism; however, the high crystallization barrier and the tendency of silica to form glasses make such simulations very challenging. Here we have studied liquid silica crystallization to β-cristobalite with metadynamics, using X-ray diffraction (XRD) peak intensities as collective variables. The frequent transitions between solid and liquid of the biased runs demonstrate the highly successful use of the XRD peak intensities as collective variables, which leads to the convergence of the free-energy surface. By calculating the difference in free energy, we have estimated the melting temperature of β-cristobalite, which is in good agreement with the literature. The nucleation mechanism during the crystallization of liquid silica can be described by classical nucleation theory.


Science ◽  
2012 ◽  
Vol 338 (6103) ◽  
pp. 87-90 ◽  
Author(s):  
Ziren Wang ◽  
Feng Wang ◽  
Yi Peng ◽  
Zhongyu Zheng ◽  
Yilong Han

The nucleation process is crucial to many phase transitions, but its kinetics are difficult to predict and measure. We superheated and melted the interior of thermal-sensitive colloidal crystals and investigated by means of video microscopy the homogeneous melting at single-particle resolution. The observed nucleation precursor was local particle-exchange loops surrounded by particles with large displacement amplitudes rather than any defects. The critical size, incubation time, and shape and size evolutions of the nucleus were measured. They deviate from the classical nucleation theory under strong superheating, mainly because of the coalescence of nuclei. The superheat limit agrees with the measured Born and Lindemann instabilities.


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