Abstract
Modeling of ionic diffusion in warm dense plasma mixtures has been of longstanding interest in astrophysics and in Inertial Confinement Fusion. Here we review traditional approaches to calculating plasma diffusion using kinetic theory. We also review earlier classical molecular dynamics (MD) results. We discuss some new results from MD for self and mutual diffusion in a mixture of deuterium and argon at warm dense matter regime. We make use of Yukawa interionic potentials as an effective potential that accounts for the screening effects of the electrons to the ions. We further provide a general description of the Green-Kubo technique to extract the diffusivity of a multicomponent mixture. The description is very general and it can be extended to plasmas.
Access this chapter
Tax calculation will be finalised at checkout
Purchases are for personal use only
References
R.E. Rudd, W.H. Cabot, K.J. Caspersen, J.A. Greenough, D.F. Richards, F.H. Streitz, P.L. Miller, Phys. Rev. E 85, 031202 (2012)
P. Amendt, O.L. Landen, H.F. Robey, C.K. Li, R.D. Petrasso, Phys. Rev. Lett. 105, 115005 (2010)
P. Amendt, S. Wilks, C. Bellei, C.K. Li, R.D. Petrasso, Phys. Plasma 18, 056308 (2011)
P. Amendt, C. Bellei, S. Wilks, Phys. Rev. Lett. 109, 075002 (2012)
D.B. Dusenbery, Living at Micro Scale (Harvard University Press, Cambridge, 2009)
G. Michaud, Astrophys. J. 160, 641 (1970)
J. Lindl, Phys. Plasmas 2, 3933 (1995)
J. Nuckolls, L. Wood, A. Thiessen, G. Zimmerman, Nature 239, 139 (1972)
S. Hamaguchi, R.T. Farouki, J. Chem. Phys. 101, 9876 (1994)
R.T. Farouki, S. Hamaguchi, J. Chem. Phys. 101, 9885 (1994)
S. Hamaguchi, R.T. Farouki, H.E. Dubin, J. Chem. Phys. 105, 7641 (1996)
R. Farouki, S. Hamaguchi, J. Comput. Phys. 115(2), 276 (1994)
R. Bird, W. Stewart, E. Lightfoot, Transport Phenomena, Wiley International Edition (Wiley, New York, 2007)
S. Chapman, T. Cowling, The Mathematical Theory of Non-uniform Gases: An Account of the Kinetic Theory of Viscosity, Thermal Conduction and Diffusion in Gases. Cambridge Mathematical Library (Cambridge University Press, Cambridge, 1970)
C. Paquette, C. Pelletier, G. Fontaine, G. Michaud, Astrophys. J. Suppl. Ser. 61, 177 (1986)
H. Ohta, S. Hamaguchi, Phys. Plasmas 7, 4506 (2000)
S.D. Baalrud, J. Daligault, Phys. Rev. Lett. 110, 235001 (2013)
E.E. Salpeter, Australian. J. Phys. 7, 373 (1954)
J.P. Hansen, G.M. Torrie, P. Vieillefosse, Phys. Rev. A 16, 2153 (1977)
S. Bastea, Phys. Rev. E 71, 056405 (2005)
Y. Rosenfeld, Phys. Rev. E 47, 2676 (1993)
Y. Rosenfeld, E. Nardi, Z. Zinamon, Phys. Rev. Lett. 75, 2490 (1995)
J. Daligault, Phys. Rev. Lett. 108, 225004 (2012)
J. Hansen, I. McDonald, Theory of Simple Liquids (Elsevier, New York, 2006)
N. March, M. Tosi, Atomic Dynamics in Liquids. Dover Books on Physics and Chemistry (Dover, New York, 1991)
D. McQuarrie, Statistical Mechanics (HarperCollinsPublishers, New York, 1976)
J. Horbach, S.K. Das, A. Griesche, M.P. Macht, G. Frohberg, A. Meyer, Phys. Rev. B 75, 174304 (2007)
J. Trullà s, J.A. Padró, Phys. Rev. E 50, 1162 (1994)
J. Daligault, Phys. Rev. Lett. 96, 065003 (2006)
A. Einstein, Annalen der Physik 322(8), 549 (1905)
R. Kubo, J. Phys. Soc. Jpn. 12(6), 570 (1957)
R. Kubo, M. Yokota, S. Nakajima, J. Phys. Soc. Jpn. 12(11), 1203 (1957)
R. Zwanzig, J. Chem. Phys. 40, 2527 (1964)
R. Zwanzig, Annu. Rev. Phys. Chem. 16, 67 (1965)
D.B. Boercker, E.L. Pollock, Phys. Rev. A 36, 1779 (1987)
C. Cohen, J.W.H. Sutherland, J.M. Deutch, Phys. Chem. Liq. 2, 213 (1971)
A.B. Bhatia, D.E. Thornton, Phys. Rev. B 2, 3004 (1970)
J.G. Kirkwood, F.P. Buff, J. Chem. Phys. 19, 774 (1951)
J.P. Hansen, G.M. Torrie, P. Vieillefosse, Phys. Rev. A 16, 2153 (1977)
D. Léger, C. Deutsch, Phys. Rev. A 37, 4916 (1988)
J. Stefan, Akad. Wiss. Wien Abt. II, 63 (1871)
J.P. Hansen, F. Joly, I.R. McDonald, Physica 132A, 4722 (1985)
M. Schoen, C. Hoheisel, Mol. Phys. 52, 1029 (1984)
D.L. Jolly, R.J. Bearman, Mol. Phys. 41, 137 (1980)
D.W. McCall, D.C. Douglass, J. Phys. Chem. 71, 987 (1967)
Y. Zhou, G.H. Miller, Phys. Rev. E 53, 1587 (1996)
L.S. Darken, Trans. AIME 175, 184 (1948)
D.C. Douglass, H.L. Frisch, J. Phys. Chem. 73, 3039 (1969)
Y. Zhou, G.H. Miller, J. Phys. Chem. 100, 5516 (1996)
J.P. Hansen, I.R. McDonald, Phys. Rev. A 11, 2111 (1975)
L. Spitzer, Physics of Fully Ionized Gases. Interscience Tracts on Physics and Astronomy (Interscience Publishers, New York, 1962)
D. Frenkel, B. Smit, Understanding Molecular Simulation: From Algorithms to Applications. Computational Science (Elsevier, Burlington, 2001)
G. Ciccotti, D. Frenkel, I. McDonald, Simulation of Liquids and Solids: Molecular Dynamics and Monte Carlo Methods in Statistical Mechanics. North-Holland Personal Library (North-Holland, New York, 1987)
N. Ashcroft, N. Mermin, Solid State Physics. Science: Physics (Saunders College, Fort Worth, 1976)
B. Firey, N.W. Ashcroft, Phys. Rev. A 15, 2072 (1977)
P. Debye, E. Hückel, Phys. Z 24, 185 (1923)
D. Pines, P. Nozieres, The Theory of Quantum Fluids (Addison-Wesley, Redwood, 1990)
S. Itchimaru, Statistical Plasma Physics (Addison-Wesley, Reading, 1991)
G. Gregori, S.H. Glenzer, W. Rozmus, R.W. Lee, O.L. Landen, Phys. Rev. E 67, 026412 (2003)
M.S. Murillo, High Energy Density Phys. 4(1–2), 49 (2008)
P.P. Ewald, Ann. Phys. 64, 253 (1921)
M. Desrno, C. Holm, J. Chem. Phys. 109, 7678 (1998)
E.L. Pollock, J. Glosli, Comp. Phys. Comm. 95, 93 (1996)
S. Nosé, J. Chem. Phys. 81, 511 (1984)
W.G. Hoover, Phys. Rev. A 31, 1695 (1985)
R.P. Feynman, N. Metropolis, E. Teller, Phys. Rev. 75, 1561 (1949).
M. Vergeles, G. Szamel, J. Chem. Phys. 110, 3009 (1999)
J. Daligault, Phys. Rev. E 86, 047401 (2012)
J. Glosli, K. Caspersen, D. Richards, R. Rudd, F. Streitz, J. Gunnels, in Proceedings of the Supercomputing 2007 (SC07), Reno, Nov 2007. UCRL-CONF-230679 pp. 276–287 (2007)
D.R. Wheeler, J. Newman, J. Phys. Chem. B 108, 18353 (2004)
Acknowledgements
The authors would like to thank Bill Cabot, Kyle Caspersen, John Castor, Jim Glosli, Frank Graziani, Jeff Greenough, Julie Jackson, A. Bruce Langdon, Paul Miller, Michael Murillo, Dave Richards, Mike Surh, Heather Whitley and all the Cimarron team for their contributions and fruitful discussions. One of us T.H. acknowledges interesting discussion with Jerome Daligault during the IPAM workshop. This work was performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under Contract DE-AC52-07NA27344. This work was funded by the Laboratory Directed Research and Development Program at LLNL under project tracking code 12-SI-005 and 10-ERD-004. We gratefully acknowledge supercomputer time provided through the Institutional Computing Grand Challenge program at LLNL.
Author information
Authors and Affiliations
Corresponding author
Editor information
Editors and Affiliations
Rights and permissions
Copyright information
© 2014 Springer International Publishing Switzerland
About this paper
Cite this paper
Haxhimali, T., Rudd, R.E. (2014). Diffusivity of Mixtures in Warm Dense Matter Regime. In: Graziani, F., Desjarlais, M., Redmer, R., Trickey, S. (eds) Frontiers and Challenges in Warm Dense Matter. Lecture Notes in Computational Science and Engineering, vol 96. Springer, Cham. https://doi.org/10.1007/978-3-319-04912-0_9
Download citation
DOI: https://doi.org/10.1007/978-3-319-04912-0_9
Published:
Publisher Name: Springer, Cham
Print ISBN: 978-3-319-04911-3
Online ISBN: 978-3-319-04912-0
eBook Packages: Mathematics and StatisticsMathematics and Statistics (R0)