Calculating the pressure in simulations using periodic boundary conditions

DOI10.1007/BF02186852zbMath0840.70013OpenAlexW2039598012MaRDI QIDQ1906419

E. R. Smith

Publication date: 19 March 1996

Published in: Journal of Statistical Physics (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1007/bf02186852

zbMATH Keywords

HamiltonianCoulomb interactionsvirial theorempressure tensor\(N\) particlesconstrained Lagrangian

Mathematics Subject Classification ID

Hamilton's equations (70H05) Continuum models (systems of particles, etc.) arising in equilibrium statistical mechanics (82B21)

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The scientific contributions of Edgar R. Smith

Cites Work

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• Hamilton's equations for constrained dynamical systems
• Electrostatic energy in ionic crystals