60th birthday of Myroslav Holovko
It is a pleasure to be involved in the preparation of the festschrifts honoring the 60th birthday of our good friend and colleague Professor Myroslav Holovko.
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60th birthday of Myroslav Holovko // Condensed Matter Physics. — 2003. — Т. 6, № 3(35). — С. 365-374. — Бібліогр.: 86 назв. — англ. |
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60th birthday of Myroslav Holovko
It is a pleasure to be involved in the preparation of the festschrifts honoring the
60th birthday of our good friend and colleague Professor Myroslav Holovko.
Myroslav Holovko was born in 1943 in a small village of Chernijiv located in a
beautiful area close to the Ukrainian Carpathians. After graduating in 1965 from
the Ivano-Frankivsk Institute of Pedagogy he became a Ph.D. student at the Phy-
sics Department of the Lviv State University under the supervision of Professor
Ihor Yukhnovskii. In 1969 Yukhnovskii became the head of Lviv Department of sta-
tistical theory of condensed states at the Institute for Theoretical Physics of the
Ukrainian Academy of Sciences. From its early beginning the Lviv group experi-
enced support and strong interest from another great Ukrainian – N.N.Bogolyubov,
who was at that time Director of the Institute for Theoretical Physics. Yukhnovskii’s
group was a fantastic place for young people to grow up as scientists. At that time
the group consisted of talented, ambitious and very enthusiastic young scientists
selected among the best students who graduated mainly, but not exclusively, from
Lviv University. It is interesting to note that Hartmut Krienke, who celebrated his
60th birthday last July was also a member of the Yukhnovskii’s group, although
Krienke came to Lviv from Rostock (Eastern Germany). Thanks to the outstanding
personality of Prof. Yukhnovskii, a warm and friendly atmosphere in the group was
combined with exceptionally high research standards.
365
In 1970 Myroslav Holovko received the degree of Ph.D. and ten years later, in
1980, the degree of Doctor of Sciences. The area of his scientific interests at that time
included a statistical mechanical theory of electrolyte solutions and molten salts. To
study these systems Holovko successfully contributed to the development of the op-
timized cluster theory (OCT). The theory is represented by a cluster expansion built
on the renormalized potential that follows from the solution of the mean spherical
approximation (MSA) integral equation. This choice of the renormalized potential
optimizes the convergence of the cluster expansion. Holovko and his coworkers have
generalized the methods used in the solution of the MSA equation for a variety
of important interaction potentials. These include several versions of ion-multipole
models, multicomponent ion-dipole models in a neutralizing background, multicom-
ponent sticky ion-dipole models. Unfortunately, for different reasons, not all of these
works were published in regular international journals. In this issue we provide a
complete reference of some of Holovko’s earlier works. During Soviet times in the
English translation of some of these papers, Holovko’s name has been incorrectly
translated as Golovko.
The OCT was utilized by Holovko to study a variety of systems and phenomena.
Having explicitly taking into account the solute-solute, solute-solvent and solvent-
solvent interactions it became possible to make a quantitative study of ionic sol-
vation. Thermodynamic functions and their derivatives with respect to the tem-
perature and pressure were studied using Padé-approximants that utilized the cor-
responding MSA solutions. Important advances were achieved by extending OCT
within the framework of a site-site formalism. This extension makes possible detailed
investigation of the effects of the molecular shape and distribution of the charge. The
combination of OCT and computer simulation techniques provided us with a set of
new and interesting results concerning dielectric and dynamic properties of water.
Using a microscopic approach, in which all particles of the system including those
belonging to the surface are treated on the same footing, a detailed investigation of
the interphase structure between the surface and electrolyte solutions was carried
out. An exact solution of the Schrödinger equation for a hydrogen-like atom near an
impenetrable surface was obtained.
Recent Holovko’s interests concern the theory of associating liquids where he
proposed a multidensity version of OCT accompanied with the corresponding ex-
tension of the MSA, which became known as the associative MSA. Further extension
and modification of the multidensity formalism enabled us to set up a solid basis
for a systematic investigation of ionic association in electrolyte solutions. This was
published in a series of the papers in which the challenging task of describing strong-
ly associating and/or highly asymmetric electrolyte solutions was successfully ad-
dressed. Somewhat later, the theory was used to explain the anomalous temperature
dependence of the capacity of the electric double layer, to investigate the electrolyte
effects in intramolecular electron-transfer reactions and to study the thermodynam-
ic and transport properties of electrolyte solutions in weakly polar solvents. Due to
the fundamental character of the formalism, its applications range from dimerizing
to network-forming fluids, from the fluids of chain molecules to micelle systems,
366
and include fluids in porous media. A simple and effective model for inverse mi-
celles was proposed and successfully used to analyze the experimental data on the
effects of adding protein on the structure, percolation and thermodynamic prop-
erties of micelle solutions. The model, which is based on the competition between
surface morphology and coverage, was used to study the effects of ice roughness on
its coverage by hydrogen chloride molecules. It was found that in network-forming
fluids the liquid-gas phase transition is located in the percolation region. In the pres-
ence of a sticky surface, the percolation threshold on the surface is achieved earlier
than in the bulk. It is demonstrated that cooperative adsorption of polymer and
network-forming fluids occurs in strongly diluted regions, which was verified by the
experiment. The application of the integral equation technique permits to study the
effects of association on the fluid electronic structure, to generate a set of new and
interesting results for anisotropic fluids, as well as for fluids in porous media.
In his 60-ty Prof. M.Holovko is a head of the Theory of Solutions Department
at the Institute of Condensed Matter Physics of the National Academy of Sciences
of Ukraine. He is the author and coauthor of scientific books, chapters in books and
encyclopedias, numerous articles in journals. In 2003 he was elected a corresponding
member of the National Academy of Sciences of Ukraine.
Finally, we thank all Myroslav Holovko’s colleagues who contributed to both
festschrifts collected in the Journal of Molecular Liquids and Condensed Matter
Physics and wish Myroslav many enjoyable and productive years with his family,
for his friends, students and colleagues.
Josef Barthel
Douglas Henderson
Andrij Trokhymchuk
367
Main publications
1. Yukhnovskii I.R., Holovko M.F. Statistical theory of equilibrium system com-
posed of particles with complicate electrostatic structure. Ukr. J. Phys., 1969,
vol. 4, No. 7, p. 1116–1126 (in Russian).
2. Yukhnovskii I.R., Vysochanskii V.S., Holovko M.F. Radial distribution func-
tions of ion-dipole systems. In: Physics of liquid state. 1978, vol. 6, p. 101–114
(in Russian).
3. Yukhnovskii I.R., Holovko M.F. Statistical theory of classical equilibrium sys-
tems. Kiev, Naukova Dumka, 1980 (in Russian).
4. Yukhnovskii I.R, Gruba V.D., Holovko M.F, Kessler Yu.M. Dependence of
the ionic potentials of mean force on the parameters and the form of the ion-
molecular interaction. Ukr. J. Phys., 1980, vol. 25, No. 10, p. 1761–1765 (in
Russian).
5. Yukhnovskii I.R., Holovko M.F., Kuryliak I.I., Soviak E.M. The method of col-
lective variables in statistical theory of inhomogeneous ion-molecular systems.
Physics of molecules, 1981, vol. 10, p. 26–43 (in Russian).
6. Holovko M.F., Pizio O.A. On the static dielectric function of simple ionic
systems. Dokl. Ukr. Acad. Sci. A, 1983, vol. 2, No. 1, p. 49–52 (in Russian).
7. Pizio O.A., Holovko M.F., Trokhymchuk A. Statistical theory of molten salts:
Charged hard sphere system. In: Physics of Many-Body Systems, 1983, No. 3,
p. 35–47 (in Russian).
8. Golovko M.F., Yukhnovskii I.R. Approaches to the many-body theory of dense
ion-dipole plasma. Application to ionic solvation. – In: The Chemical Physics
of Solvation, vol. A. – Elsevier, Amsterdam, 1985, Chapt. 6, p. 207–262.
9. Holovko M.F., Kuryliak I.I., Pizio O.A., Soviak E.M. Reference interactions
in the statistical theory of ion-molecular systems. – In: Problems of mod-
ern statistical physics (ed. by N.N. Bogolubov), Kiev, Naukova Dumka, 1985,
p. 82–96.
10. Golovko M.F., Krienke H. General virial expansions. Mol. Phys., 1989, vol. 68,
No. 4. p. 967–977.
11. Holovko M.F., Kalyuzhnyi Yu.V. Analytic solution of the reference interac-
tion site model equation for a mixture of hard spheres and symmetric rigid
molecules. J. Phys.: Condens. Matter., 1989, vol. 1, p. 2891–2909.
12. Holovko M.F., Kalyuzhnyi Yu.V. Screened potentials of the site-site ion-mole-
cular model. The mean spherical approximation. Mol. Phys., 1989, vol. 66,
p. 375–396.
368
13. Kovalenko A.F., Soviak E.N., Golovko M.F. Electronic states of hydrogen atom
near a hard wall. Phys. Stat. Sol.(b), 1989, vol. 155, p. 549–558.
14. Golovko M.F., Protsykevich I.A. Analytic solution of the mean spherical ap-
proximation for ion-dipole model in a neutralizing background. J. Stat. Phys.,
1989, vol. 54, p. 707–733.
15. Lvov S.N., Umniashkin V.A., Sharygin A., Golovko M.F. The molecular sta-
tistical theory of infinite dilute solutions based on the ion-dipole model with
Lennard-Jones interactions. Fluid Phase Equilibria, 1990, vol. 58, p. 283–305.
16. Kalyuzhnyi Yu.V., Holovko M.F., Nezbeda I. Analytic solution of the RISM
equation for n-atomic symmetric molecules. Czech. J. Phys., 1990, vol. 40,
p. 1098–1106.
17. Holovko M.F., Kalyuzhnyi Yu.V., Heinzinger K. Electrostatic and packing
contributions to the structure of water and aqueous electrolyte solutions.
Z.Naturforsch., 1990, vol. 45a, p. 687–694.
18. Holovko M.F., Kalyuzhnyi Yu.V. On the effects of association in the statisti-
cal theory of ionic systems. Analytic solution of the PY-MSA version of the
Wertheim theory. Mol.Phys., 1991, vol. 73, p. 1145–1157.
19. Kalyuzhnyi Yu.V., Holovko M.F., Haymet A.D.J. Integral equation theory for
associating liquids: Weakly associated 2–2 electrolytes. J. Chem. Phys., 1991,
vol. 95, p. 9151–9164.
20. Kovalenko A.F., Soviak E.M., Holovko M.F. On the quantum properties of
adsorbed particles within the model of a hydrogen atom near a hard wall.
Intern. J. Quantum Chem., 1992, vol. 42, p. 321–337.
21. Kovalenko A.F., Holovko M.F. A hydrogen-like atom near a potential barrier.
J. Phys. B, 1992, vol. 25, p. L233–236.
22. Trokhymchuk A., Holovko M.F., Spohr E., Heinzinger K. Combination of com-
puter simulation methods and optimized cluster theory in determining equilib-
rium properties of electrolyte solutions. Mol. Phys., 1992, vol. 77, p. 903–920.
23. Pizio O.A., Holovko M.F., Haymet A.D.J., Henderson D. On the application
of the theory of inhomogeneous system for the triplet and higher-order distri-
bution functions. J. Mol. Liq., 1993, vol. 58, p. 101–115.
24. Trokhymchuk A., Holovko M.F., Heinzinger K. Static dielectric properties of
the flexible model of water. J. Chem. Phys., 1993, vol. 99, p. 2964–2971.
25. Holovko M.F., Badiali J.P. Effect of an association potential on the percolation.
Application to reverse micelles containing proteins. Chem. Phys. Lett., 1993,
vol. 204, p. 511–516.
369
26. Kalyuzhnyi Yu.V., Protsykevytch I.A., Holovko M.F. Solution of the associa-
tive Percus-Yevick approximation for n-component mixture of dimerizing hard
spheres. Chem. Phys. Lett., 1993, vol. 215, p. 1–4.
27. Holovko M.F., Kovalenko A.F., Soviak E. Particle quantum properties next
to non-metallic surfaces. Condens. Matter Phys. , 1993, iss. 1, p. 13–25 (in
Ukrainian).
28. Badiali J.P., Russier V., Holovko M.F. Analysis of the Henderson-Abraham-
Barker equation in the case of a polar liquid near a neutral hard wall. J. Chem.
Phys., 1993, vol. 99, No. 10, p. 8051–8055.
29. Trokhymchuk A., Holovko M.F., Henderson D. The contribution of dipole
alignment into the force between macroions in ion-dipole fluid. Mol. Phys.,
1993, vol. 80, p. 1009–1020.
30. Kalyuzhnyi Yu.V., Holovko M.F. An analytical study of the effects of associa-
tion in the 2–2 electrolyte solution. I. Associative mean spherical approxima-
tion. Mol. Phys., 1993, vol. 80, No. 5, p. 1165–1176.
31. Kalyuzhnyi Yu.V., Stell G., Llano-Restrepo M.L., Chapman W.G., Holov-
ko M.F. Primitive models of chemical association: Theory and simulation for
dimerization. J. Chem. Phys., 1994, vol. 101, No. 9, p. 7939–7952.
32. Kalyuzhnyi Yu.V., Vlachy V., Holovko M.F., Stell G. Multidensity integral
equation theory for highly asymmetric electrolyte solutions. J. Chem. Phys.,
1995, vol. 102, No. 14, p. 5770–5780.
33. Holovko M.F., Vakarin E.V. An associative version of the Henderson-Abraham-
Barker equation. Mol. Phys., 1995, vol. 84, p. 1057–1064.
34. Kalyuzhnyi Yu.V., Stell G., Holovko M.F. Analytical solution of the multi-
density OZ equation for polymerizing fluid. Chem. Phys. Lett., 1995, vol. 235,
p. 355–364.
35. Trokhymchuk A., Holovko M.F., Heinzinger K. On the structure factor for
water at small wavenumbers. Z. Naturforsch., 1995, vol. 50, p. 18–20.
36. Holovko M.F., Soviak E.M. Reference interactions in the statistical theory of
electrolyte solutions. Condens. Matter Phys., 1995, iss. 6, p. 49–78.
37. Trokhymchuk A., Holovko M.F., Heinzinger K. Density and charge correlations
in water. Mol. Phys., 1995, vol. 86, p. 797–808.
38. Protsykevich I.A., Duda Yu., Holovko M.F. Solution of the associative PYA
for multicomponent mixture of dimerizing hard spheres with surface adhesion.
Chem. Phys. Lett., 1996, vol. 248, p. 57–62.
370
39. Duda Yu., Kalyuzhnyi Yu.V., Holovko M.F. Solution of the associate MSA for
the shielded sticky point electrolyte model. J. Chem. Phys., 1996, vol. 104,
p. 1081–1089.
40. Trokhymchuk A., Pizio O., Holovko M.F., Sokolovski S. Adsorption of fluids
in disordered porous media from the multidensity integral equation theory.
Associative analogue of the Madden-Glandt Ornstein-Zernike approximation.
J. Phys. Chem., 1996, vol. 100, p. 17004–17010.
41. Trokhymchuk A., Holovko M.F. Frequency- and wave-vector-dependent sus-
ceptibility of water. J. Phys. Chem., 1996, vol. 100, No. 2, p. 1411–1414.
42. Holovko M.F., Vakarin E.V. Density profiles of a hard-sphere chain fluid near a
hard wall. Application to the adsorption onto a crystalline surface. Mol. Phys.,
1996, vol. 87, No. 6, p. 1375–1394.
43. Holovko M.F., Vakarin E.V. The role of association effects in theory of an
electrified interface. Mol. Phys., 1996, vol. 87, No. 1, p. 123–127.
44. Blum L., Holovko M.F., Protsykevych I.A. A solution of the multiple binding
mean spherical approximation for ionic mixtures. J. Stat. Phys., 1996, vol. 84,
p. 191–204.
45. Sokolowska T., Holovko M.F. Analytic solution of OZ equation in the mean
spherical approximation for nematic systems. Ukr. J. Phys., 1996, vol. 41,
No. 10, p. 933–939.
46. Vakarin E., Duda Yu., Holovko M.F. Integral equation theory for the four
bonding sites model of associating fluids. I. Structure factor and compressibil-
ity. Mol. Phys., 1997, vol. 90, No. 4, p. 611–625.
47. Vakarin E., Holovko M.F., Duda Yu. Integral equation theory for the four
bonding sites model of associating fluids. II. Density profiles and adsorption
onto a solid surface. Mol. Phys., 1997, vol. 91, No. 2, p. 203–214.
48. Vakarin E., Duda Yu., Holovko M.F. Continuum percolation of the four bond-
ing site associating fluids. J. Stat. Phys., 1997, vol. 88, No. 5/6, p. 1333–1352.
49. Trokhymchuk A., Pizio O., Holovko M.F., Sokolovski S. Associative replica
OZ equations and the structure of chemically reacting fluids in porous media.
J. Chem. Phys., 1997, vol. 106, No. 1, p. 200–209.
50. Vakarin E., Holovko M.F. Interfacial structure of dimerizing and hard sphere
chain fluids in the vicinity of a crystalline surface: effect of a cooperative
adsorption. Mol. Phys., 1997, vol. 90, No. 1, p. 63–73.
51. Kalyuzhnyi Yu.V., Blum L., Holovko M.F., Protsykevych I.A. Solution of the
polymer mean spherical approximation for totally flexible sticky two-point
electrolyte model. J. Mol. Liq., 1997, vol. 73/74, p. 1–26.
371
52. Holovko M.F., Protsykevych I.A., Kalyuzhnyi Yu.V., Blum L. Primitive model
for highly asymmetric electrolytes. Associative mean spherical approximation.
Physica A., 1997, vol. 236, p. 85–96.
53. HCassin G., Duda Yu.Ya., Holovko M.F., Badiali J.P., Pileni M.P. Cyto-
chrome-c in reverse micelles. Small angle X-ray scattering measurements, per-
colation process and critical behavior: An interpretation with an association
model. J. Chem. Phys., 1997, vol. 107, No. 7, p. 2683–2693.
54. Voronov A., Luzinov I., Minko S., Sidorenko A., Vakarin E., Holovko M.F. Ad-
sorption of polymers at two-dimensional diluted to semidiluted regime. Macro-
molecules, 1997, vol. 30, p. 6929–6936.
55. Duda Yu.Ya., Holovko M.F. Structure of liquid sulfur through polymer Percus-
Yevick theory. Phys. Chem. Liquid., 1997, vol. 35, p. 175–189.
56. Duda Yu., Vakarin E., Kalyuzhnyi Yu., Holovko M.F. Analytical treatment of
the fused hard-sphere chain model: 0.5 < L < 1. Physica A, 1997, vol. 245,
p. 393–410.
57. Vakarin E., Duda Yu., Holovko M.F. Cooperative adsorption of network form-
ing fluids onto crystalline surfaces. Structure and connectivity of the interface.
J. Chem. Phys., 1997, vol. 107, No 14, p. 4961–4973.
58. Holovko M.F. New aspects in the theory of aqueous electrolyte solutions: the
effects of cation hydrolysis and polynuclear ion formation. Condens. Matter
Phys., 1997, iss. 12, p. 13–25.
59. Vakarin E., Duda Yu., Holovko M.F. Polymers near a solid surface: fused hard
sphere chain model. J. Mol. Liq., 1998, vol. 75, p. 77–95.
60. Segura C.J., Vakarin E.V., Chapman W.G., Holovko M.F. A comparison of
density functional and integral equation theories as Monte Carlo simulations
for hard sphere associating fluids near a hard wall. J. Chem. Phys., 1998,
vol. 108, No. 12, p. 4837–4848.
61. Duda Yu., Segura C.J., Vakarin E., Holovko M.F., Chapman W.G. Network
forming fluids: Integral equations and Monte Carlo simulations. J. Chem.
Phys., 1998, vol. 108, No. 21, p. 9168–9176.
62. Lomba E., Lopez-Martin J.L., Holovko M.F. Chemical association and elec-
tronic structure: A new theoretical approach. J. Chem. Phys., 1998, vol. 108,
No. 24, p. 10175–10180.
63. Holovko M.F. The multidensity integral equation approach in the theory of
complex liquids. Condens. Matter Phys., 1999, No. 2(18), p. 205–220.
372
64. Holovko M.F., Polishchuk Z.V. The screening potentials of ion-dipole system
adsorbed in ion-dipolar disordered matrices. Condens. Matter Phys., 1999,
No. 2(18), p. 267–272.
65. Holovko M.F., Sokolovska T.G. Analytical solution of the Ornstein-Zernike
equation with the mean spherical closure for a nematic phase. J. Mol. Liq.,
1999, vol. 82, p. 161–181.
66. Vakarin E.V., Filippov A.E., Badiali J.P., Holovko M.F. Structural rearrange-
ment of solid surfaces due to competing adsorbate-substrate interactions. Phys.
Rev. E., 1999, vol. 60, p. 660–674.
67. Holovko M.F., Vakarin E.V. Modelling of the elementary surface processes
occurring in the course of heterogeneous catalytic reactions. Condens. Matter
Phys., 2000, vol. 3, No. 2(22), p. 417–436.
68. Barthel J., Krienke H., Holovko M.F., Kapko V.I., Protsykevich I.A. The ap-
plication of the associative mean spherical approximation in the theory of non-
aqueous electrolyte solutions. Condens. Matter Phys., 2000, vol. 3, No. 3(23),
p. 657–674.
69. Holovko M.F., Kapko V.I. Associative mean spherical approximation for ion-
molecular systems: Ion-dipole model with ionic, molecular and ion-molecular
associations. J. Mol. Liq., 2000, vol. 87, p. 109–128.
70. Holovko M.F., Kalyuzhnyi Yu.V., Druchok M.Yu. On the theory of cation
hydrolysis in aqueous electrolyte solutions. J. Phys. Studies., 2000, vol. 4,
No. 1, p. 100–107.
71. Sokolovska T.G., Sokolovskii R.O., Holovko M.F. Orientational ordering in
fluids with partially constrained molecule orientations. Phys. Rev. E., 2000,
vol. 62, p. 6771–6779.
72. Kalyuzhnyi Yu.V., Holovko M.F., Vlachy V. Highly asymmetric electrolytes in
the associative mean-spherical approximation. J. Stat. Phys., 2000, vol. 100,
p. 243–263.
73. Krienke H., Barthel J., Holovko M.F., Protsykevich I., Kalyuzhnyi Yu. Osmotic
and activity coefficients associated electrolytes over large concentration ranges
from chemical model calculations. J. Mol. Liq., 2000, vol. 87, p. 191–216.
74. Protsykevich I.A., Holovko M.F., Kondrat S.V. The reference system for a
highly asymmetric electrolyte solutions: The analytical treatment. J. Mol. Liq.,
2000, vol. 88, p. 65–75.
75. Holovko M.F., Sovyak E.M. Renormalized potential of nonuniform system:
Ion-molecular mixture – porous media. J. Phys. Studies, 2000, vol. 4, p. 391–
402.
373
76. Patsagan T., Trokhymchuk A., Holovko M.F. The structure and dynamical
properties of the simple fluids in porous media. J. Mol. Liq., 2001, vol. 92,
No. 1–2, p. 117–124.
77. Holovko M.F., Kapko V., Henderson D., Boda D. On the influence of ionic
association on the capacitance of an electrical double layer. Chem. Phys. Lett.,
2001, vol. 342, p. 363–368.
78. Holovko M.F., Kondrat S.V. Connection of Landau-Ginzburg models with con-
tinuous microscopic approach for self-assembling systems. J. Mol. Liq., 2001,
vol. 92, No. 1–2, p. 125–130.
79. Vakarin E.V., Holovko M.F., Baidali J.P. Adsorbate induced distortion of sol-
id surfaces. Application to HCl on ice at stratospheric conditions. Condens.
Matter Phys., 2001, vol. 4, p. 251–276.
80. Sokolovska T.G., Sokolovskii R.O., Holovko M.F. Nematic model in the pres-
ence of a finite disorienting field: Integral equation approach. Phys. Rev. E.,
2001, p. 051710.
81. Vakarin E.V., Holovko M.F. Adsorption of HCl on ice. Effects of the surface
heterogeneity. Chem. Phys. Lett., 2001, vol. 349, p. 13–18.
82. Vakarin E.V., Holovko M.F., Piotrowiak P. Ion-pairing effects in intramolecular
electron transfer. Chem. Phys. Lett., 2002, vol. 363, p. 7–12.
83. Holovko M.F. Association and clusterization in liquids and solutions. A mul-
tidensity integral equation approach. J. Mol. Liq., 2002, vol. 96–97, p. 65–85.
84. Barthel J., Krienke H., Neuder R., Holovko M.F. The role of ion-aggregate
formation in the calculation of physical properties of electrolyte solutions.
Fluid Phase Equilibria, 2002, vol. 194–197, p. 107–122.
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