Interactions of components and elements of the surface free energy at interfaces

1991 ◽  
Vol 56 (2) ◽  
pp. 277-295 ◽  
Author(s):  
Jan Kloubek
Keyword(s):  
Free Energy ◽  
Surface Free Energy ◽  
Polar Phase ◽  
Free Energies ◽  
Dispersion Component ◽  
Liquid Systems ◽  
Interfacial Free Energies ◽  
Total Surface Free Energy ◽  
Solid Liquid ◽  
New Hypothesis

A new hypothesis is suggested for the evaluation of the components (γd and γab) and the elements (γa and γb) of the surface free energy. The respective equations are introduced for the interactions at interfaces between a non-polar acid and non-polar base, a polar phase and non-polar acid or base, and two polar phases. The dispersion component, γd, equals the total surface free energy of non-polar phases. However, they can interact at the interface as an acid or a base through their single permanent elements γa or γb, respectively. Otherwise, induced elements γia and γib can also be effective. The surface free energy of polar phases is additively composed of the dispersion, γd, and acid-base components, γab = 2(γaγb)1/2. The proposed equation are verified using the known values of the surface and interfacial free energies for the liquid-liquid systems and they are applied to the solid-liquid interfaces. The values of the elements are determined for water, γwa = 67.7 and γwb = 10.6 mJ/m2, and for other liquids, such as glycerol, formamide, mercury, benzene, diethyl ether and trichloromethane.

Molecular orientation of liquid aliphatic hydrocarbons on the surface and at the interface with water

1989 ◽  
Vol 54 (12) ◽  
pp. 3171-3186 ◽  
Author(s):  
Jan Kloubek
Keyword(s):  
Free Energy ◽  
Surface Free Energy ◽  
Molecular Orientation ◽  
Phase Changes ◽  
Aliphatic Hydrocarbons ◽  
Water Molecules ◽  
Free Energies ◽  
Dispersion Component ◽  
System Water ◽  
Orientation Of Molecules

The validity of the Fowkes theory for the interaction of dispersion forces at interfaces was inspected for the system water-aliphatic hydrocarbons with 5 to 16 C atoms. The obtained results lead to the conclusion that the hydrocarbon molecules cannot lie in a parallel position or be randomly arranged on the surface but that orientation of molecules increases there the ration of CH3 to CH2 groups with respect to that in the bulk. This ratio is changed at the interface with water so that the surface free energy of the hydrocarbon, γH, rises to a higher value, γ’H, which is effective in the interaction with water molecules. Not only the orientation of molecules depends on the adjoining phase and on the temperature but also the density of hydrocarbons on the surface of the liquid phase changes. It is lower than in the bulk and at the interface with water. Moreover, the volume occupied by the CH3 group increases on the surface more than that of the CH2 group. The dispersion component of the surface free energy of water, γdW = 19.09 mJ/m2, the non-dispersion component, γnW = 53.66 mJ/m2, and the surface free energies of the CH2 and CH3 groups, γ(CH2) = 32.94 mJ/m2 and γ(CH3) = 15.87 mJ/m2, were determined at 20 °C. The dependence of these values on the temperature in the range 15-40 °C was also evaluated.

Quantitative Evaluation of the Interfacial Free Energies at A Solid-Liquid Lamellar Eutectic Interface

1981 ◽  
Vol 12 ◽  
Author(s):  
W. F. Kaukler ◽  
J. W. Rutter
Keyword(s):  
Free Energy ◽  
Solid Phase ◽  
Interfacial Free Energy ◽  
Eutectic System ◽  
Liquid Interfaces ◽  
Free Energies ◽  
Two Phases ◽  
Interfacial Free Energies ◽  
The Individual ◽  
Solid Liquid

The solid-liquid interfacial free energies of each of the individual phases comprising the eutectic system, Carbon Tetrabromide-Hexachloroethane, were measured as a function of composition using a “grain boundary groove” technique. Thermodynamic data were combined with groove shape measurements made from high resolution optical photomicrographs of the solid-liquid interfaces to give the interfacial free energy data. An interfacial free energy balance at the eutectic trijunction was performed to obtain all the forces acting on that point. The three interphase interfacial free energies at the eutectic trijunctions as well as a solid-solid phase boundary torque were evaluated.It was found that the solid-liquid interfacial free energies of the two phases of the eutectic could be evaluated from photomicrographs of growing or stationary eutectic interfaces. In addition, it was found that for a substantial range of freezing conditions the eutectic interface shape can be predicted from a knowledge of the interfacial free energies alone.

Investigation of some phenomena occurring during continuous ink-jet printing of ceramics

2001 ◽  
Vol 16 (2) ◽  
pp. 373-384 ◽  
Author(s):  
B. Y. Tay ◽  
M. J. Edirisinghe
Keyword(s):  
Surface Tension ◽  
Free Energy ◽  
Surface Free Energy ◽  
Modulation Frequency ◽  
Free Energies ◽  
Ink Jet Printing ◽  
Ink Jet ◽  
Jet Printing ◽  
Vertical Walls ◽  
Total Surface Free Energy

A ceramic ink was prepared, characterised, and subjected to continuous ink-jet printing. The optimum modulation frequency for printing was estimated. The surface free energies of several substrates were determined and different patterns of the ink droplets were printed on these. Phenomena occurring during the process were investigated. The drop-by-drop resolution and ink spreading were found to be dependent on the dispersive/total surface free energy ratio of the substrates. Ink drying was accompanied by powder migration in the droplets deposited on substrates with a surface free energy lower than the surface tension of the ink. Printing of multiple layers was accompanied by the appearance of ridges, splattering, and non-vertical walls. The causes of these phenomena are discussed in this paper.

Interaction at interfaces and induction of surface free energy components

1987 ◽  
Vol 52 (2) ◽  
pp. 271-286 ◽  
Author(s):  
Jan Kloubek
Keyword(s):  
Free Energy ◽  
Surface Free Energy ◽  
Organic Liquid ◽  
Interaction Mechanism ◽  
Work Of Adhesion ◽  
Polar Component ◽  
Published Data ◽  
Free Energies ◽  
Dispersion Component ◽  
Mechanism Of Interaction

A set of published data on surface free energy (γ1, γ2) and interfacial energy (γ12) for interfaces mercury-organic liquid, mercury-water, and water-organic liquid (125 pairs altogether) has been critically evaluated. It has been found that the Antonow rule does not hold, that the Neumann equation is suitable for determining the work of adhesion, if γ1 and γ2 are not too different, and that the Fowkes equation can be used to assess the type of interaction at the interface. A hypothesis has been suggested which states that, besides the interaction between dispersion components of the surface free energies of the adjoining phases and the interaction between the non-dispersion components of the same type in bulk, a non-dispersion component of one phase may interact by inducing a component of the same type in the other phase near the interface. Relations concerning the mechanism of interaction at the interface have been derived. Also, the relation between the Girifalco-Good, Neumann and complemented Fowkes equation has been evaluated. For the particular liquids the dispersion portion of their surface free energies and the interaction mechanism at their interface with water and mercury have been estimated. For water, e.g. the polar component of the surface free energy (14.7 mJ m-2) and the hydrogen-bond component (36.3 mJ m-2) have been determined. The introduction of the induced component of the surface free energy is shown, as an example, for water-aromatic hydrocarbons and water-alcohols systems.

scholarly journals Optical Properties and van der Waals - London Dispersion Interactions of Polystyrene Determined by Vacuum Ultraviolet Spectroscopy and Spectroscopic Ellipsometry

2007 ◽  
Vol 60 (4) ◽  
pp. 251 ◽  
Author(s):  
Roger H. French ◽  
Karen I. Winey ◽  
Min K. Yang ◽  
Weiming Qiu
Keyword(s):  
Free Energy ◽  
Optical Properties ◽  
Surface Free Energy ◽  
Vacuum Ultraviolet ◽  
Van Der Waals ◽  
Interband Transitions ◽  
Dispersion Interactions ◽  
Dispersion Component ◽  
London Dispersion ◽  
Hamaker Constants

The interband optical properties of polystyrene in the vacuum ultraviolet (VUV) region have been investigated using combined spectroscopic ellipsometry and VUV spectroscopy. Over the range 1.5–32 eV, the optical properties exhibit electronic transitions we assign to three groupings, E1, E2, and E3, corresponding to a hierarchy of interband transitions of aromatic (π → π*), non-bonding (n → π*, n → σ*), and saturated (σ → σ*) orbitals. In polystyrene there are strong features in the interband transitions arising from the side-chain π bonding of the aromatic ring consisting of a shoulder at 5.8 eV (E1′) and a peak at 6.3 eV (E1), and from the σ bonding of the C–C backbone at 12 eV (E3′) and 17.1 eV (E3). These E3 transitions have characteristic critical point line shapes associated with one-dimensionally delocalized electron states in the polymer backbone. A small shoulder at 9.9 eV (E2) is associated with excitations possibly from residual monomer or impurities. Knowledge of the valence electronic excitations of a material provides the necessary optical properties to calculate the van der Waals–London dispersion interactions using Lifshitz quantum electrodynamics theory and full spectral optical properties. Hamaker constants and the van der Waals–London dispersion component of the surface free energy for polystyrene were determined. These Lifshitz results were compared to the total surface free energy of polystyrene, polarity, and dispersive component of the surface free energy as determined from contact angle measurements with two liquids, and with literature values. The Lifshitz approach, using full spectral Hamaker constants, is a more direct determination of the van der Waals–London dispersion component of the surface free energy of polystyrene than other methods.

Temperature-Dependent Wettability of Water on a Nickel Surface at Pressurized Condition: A Molecular Dynamics Study

2019 ◽  
Author(s):  
Dong-Lei Zeng ◽  
Biao Feng ◽  
Jia-Wen Song ◽  
Li-Wu Fan
Keyword(s):  
Contact Angle ◽  
Hydrogen Bonds ◽  
Average Energy ◽  
Contact Angles ◽  
Nickel Surface ◽  
Free Energies ◽  
Water Droplets ◽  
Temperature Dependent ◽  
Interfacial Free Energies ◽  
Solid Liquid

Abstract Temperature-dependent wettability of water droplets on a metal surface in a pressurized environment is of great theoretical and practical significance. In this paper, molecular dynamic simulation is used to study this problem by relating the temperature-dependent apparent contact angles to the changes in solid-liquid and solid-vapor interfacial free energies and hydrogen bonds in the nano-sized water droplets with increasing the temperature. The temperature range of interest is set from 298 K to 538 K in a 20 K interval under a constant pressure of 7 MPa. The results show that the contact angle in general decreases with raising the temperature and decreasing trend can be divided into two sections with different slopes. The contact angle drops slowly when the temperature is below 458 K as a critical point. Beyond this point, the contact angle shows a much steeper decrease. The difference between solid-vapor and solid-liquid interfacial free energies is found to decrease slightly with temperature. Combining with that the surface tension drops with increasing the temperature, a decreasing trend of the contact angle is expected according to the Young’s equation. As the temperature increases, the number and average energy of the hydrogen bonds both decrease, and the hydrogen bonds tend to aggregate at the bottom of the nano-droplets.

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