Abstract

The equation of state for an ideal gas is simple, which is . In the case of imperfect gases where mutual interactions among the constituents are important, pressure P can be expressed as the series expansion of density n with appropriate coefficients, known as virial coefficients . In this paper, we have obtained the first four virial coefficients for a model interaction potential using multidimensional Monte-Carlo integration and importance sampling methods. Next, we perform molecular dynamics simulations with the same for a many-particle system to obtain P as a function of T and n. We compare our numerical data with the virial equation of state.

Full Text
Published version (Free)

Talk to us

Join us for a 30 min session where you can share your feedback and ask us any queries you have

Schedule a call