Energy exchange between mesoparticles and their internal degrees of freedom

Physical Review Letters

Volumn 94, Issue 1, 2005, Pages

  Strachan, Alejandro ^a   Lee Holian, Brad ^a  

^a LOS ALAMOS NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ENERGY EXCHANGE; INTERNAL DEGREES OF FREEDOM; MESOPARTICLES; SMOOTH PARTICLE HYDRODYNAMICS (SPH);

CRYSTALLINE MATERIALS; ENERGY TRANSFER; ENERGY UTILIZATION; HAMILTONIANS; HYDRODYNAMICS; INORGANIC POLYMERS; MESOPOROUS MATERIALS; MOLECULAR DYNAMICS; SHOCK WAVES; THERMODYNAMICS; THERMOSTATS; WAVE TRANSMISSION;

DEGREES OF FREEDOM (MECHANICS);

EID: 18144390236     PISSN: 00319007     EISSN: 10797114     Source Type: Journal    
DOI: 10.1103/PhysRevLett.94.014301     Document Type: Article

References (17)

1. B. L. Holian, Europhys. Lett. 64, 330 (2003).
2. H. Häkkinen and U. Landman, Phys. Rev. Lett. 71, 1023 (1993).
3. Florian Muller-Plathe, Chem. Phys. Chem. 3, 754 (2002); K. Fremer, Macromol. Chem. Phys. 204, 257 (2003).
4. Florian Muller-Plathe, Chem. Phys. Chem. 3, 754 (2002); K. Fremer, Macromol. Chem. Phys. 204, 257 (2003).
5. L. Lucy, Astron. J. 82, 1013 (1977); J. J. Monaghan, Annu. Rev. Astron. Astrophys. 30, 543 (1992).
6. L. Lucy, Astron. J. 82, 1013 (1977); J. J. Monaghan, Annu. Rev. Astron. Astrophys. 30, 543 (1992).
7. O. Kum, W. G. Hoover, and H. A. Posch, Phys. Rev. E 52, 4899 (1995).
8. See EPAPS Document No. E-PRLTAO-94-054503 for the following: (i) A description of the mesopotential used to describe the interactions between poly(vinylidene fluoride) (PVDF) molecules, (ii) The weighting function used to calculate local temperature and velocity of the mesoparticles. (iii) An algorithm to integrate the new mesodynamics equations of motion. A direct link to this document may be found in the online article's HTML reference section. The document may also be reached via the EPAPS homepage (http://www.aip.org/ pubservs/epaps.html) or from ftp.aip.org in the directory /epaps/. See the EPAPS homepage for more information.
9. J. J. Monaghan, J. Comput. Phys. 82, 1 (1989); J. P. Gray, J. J. Monaghan, and R. P. Swift, Comput. Methods Appl. Mech. Eng. 190, 6641 (2001).
10. J. J. Monaghan, J. Comput. Phys. 82, 1 (1989); J. P. Gray, J. J. Monaghan, and R. P. Swift, Comput. Methods Appl. Mech. Eng. 190, 6641 (2001).
11. O. B. Firsov, Sov. Phys. JETP 9, 1076 (1959); M. Moseler, J. Nordiek, and H. Haberland, Phys. Rev. B 56, 15 439 (1997).
12. O. B. Firsov, Sov. Phys. JETP 9, 1076 (1959); M. Moseler, J. Nordiek, and H. Haberland, Phys. Rev. B 56, 15 439 (1997).
13. H. Berendsen, J. Postma, W. van Gunsteren, A. Dinola, and J. Haak, J. Chem. Phys. 81, 3684 (1984).
14. A. Strachan, T. C. Germann, and B. L. Holian (to be published).
15. B. L. Holian, A. F. Voter, and R. Ravelo, Phys. Rev. E 52, 2338 (1995).
16. T. Furukawa, Phase Transit. 18, 143 (1989).
17. N. Karasawa and W. A. Goddard III, Macromolecules 25, 7268 (1992).