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Volumn 85, Issue 5, 2000, Pages 1004-1007

Fifth-order Raman spectrum of an atomic liquid: simulation and instantaneous-normal-mode calculation

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIC PHYSICS; COMPUTER SIMULATION; FLUID DYNAMICS; FOURIER TRANSFORMS; MATRIX ALGEBRA; MOLECULAR SPECTROSCOPY; MOLECULAR VIBRATIONS; NUMERICAL ANALYSIS; QUANTUM THEORY; RAMAN SCATTERING; XENON;

EID: 0034226148     PISSN: 00319007     EISSN: None     Source Type: Journal    
DOI: 10.1103/PhysRevLett.85.1004     Document Type: Article
Times cited : (92)

References (30)
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    • to be published
    • D. A. Blank, L. J. Kaufman, and G. R. Fleming, J. Chem. Phys. 111, 3105 (1999); D. Ulness, J. C. Kirkwood, and A. C. Albrecht, ibid. 108, 3897 (1998); D. A. Blank, G. R. Fleming, M. Cho, and A. Tokmakoff (to be published).
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    • The first fully correct INM formulation of 5th-order Raman was presented by T. Keyes and J. T. Fourkas, J. Chem. Phys. 112, 287 (2000), but the complete spectrum was never calculated.
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    • note
    • The additional term, given explicitly in Ret. [13], is numerically insignificant here.
  • 28
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    • note
    • (ε) at reduced density p* = 0.8 and reduced temperature T* = 1.0 using very small (N = 32 atom) simulations. Finite size effects were assessed by comparing ID slices of the 2D results with those from 108 atom simulations; differences were barely discernible on this scale.
  • 29
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    • note
    • 2 axis (also predicted by INM theory) seems particularly characteristic.


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