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Updated: Apr 11, 2026

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Computation of virial coefficients from integral equations.

Cheng Zhang1, Chun-Liang Lai1, B Montgomery Pettitt1

  • 1Department of Biochemistry and Molecular Biology, Sealy Center for Structural Biology and Molecular Biophysics, The University of Texas Medical Branch, Galveston, Texas 77555-0304, USA.

The Journal of Chemical Physics
|June 8, 2015
PubMed
Summary

A new polynomial-time method efficiently computes virial coefficients using integral equations and series transformations. This approach accurately determines coefficients for hard-sphere and Gaussian models in high dimensions.

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