Microcanonical ensemble: Difference between revisions

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== References ==
== References ==
# D. Frenkel and B. Smit, "Understanding Molecular Simulation: From Alogrithms to Applications", Academic Press
# D. Frenkel and B. Smit, "Understanding Molecular Simulation: From Algorithms to Applications", Academic Press

Revision as of 11:26, 27 February 2007

Microcanonical Ensemble (Clasical statistics):

Ensemble variables

(One component system, 3-dimensional system, ... ):

  • Failed to parse (SVG (MathML can be enabled via browser plugin): Invalid response ("Math extension cannot connect to Restbase.") from server "https://wikimedia.org/api/rest_v1/":): {\displaystyle \left. N \right. } : Number of Particles
  • Failed to parse (SVG (MathML can be enabled via browser plugin): Invalid response ("Math extension cannot connect to Restbase.") from server "https://wikimedia.org/api/rest_v1/":): {\displaystyle \left. V \right. } : Volumne
  • Failed to parse (SVG (MathML can be enabled via browser plugin): Invalid response ("Math extension cannot connect to Restbase.") from server "https://wikimedia.org/api/rest_v1/":): {\displaystyle \left. E \right. } : Internal enerrgy (kinetic + potential)

Partition function

where:

  • Failed to parse (SVG (MathML can be enabled via browser plugin): Invalid response ("Math extension cannot connect to Restbase.") from server "https://wikimedia.org/api/rest_v1/":): {\displaystyle \left. h \right. } is the Planck constant
  • Failed to parse (SVG (MathML can be enabled via browser plugin): Invalid response ("Math extension cannot connect to Restbase.") from server "https://wikimedia.org/api/rest_v1/":): {\displaystyle \left( q \right)^{3n} } represents the 3N Cartesian position coordinates.
  • Failed to parse (SVG (MathML can be enabled via browser plugin): Invalid response ("Math extension cannot connect to Restbase.") from server "https://wikimedia.org/api/rest_v1/":): {\displaystyle \left( p \right)^{3n} } represents the 3N momenta.
  • Failed to parse (SVG (MathML can be enabled via browser plugin): Invalid response ("Math extension cannot connect to Restbase.") from server "https://wikimedia.org/api/rest_v1/":): {\displaystyle H \left(p,q\right) } represent the Hamiltonian, i.e. the total energy of the system as a function of coordinates and momenta.
  • Failed to parse (Conversion error. Server ("https://wikimedia.org/api/rest_") reported: "Cannot get mml. Server problem."): {\displaystyle \delta \left(x\right)} is the Dirac delta function

References

  1. D. Frenkel and B. Smit, "Understanding Molecular Simulation: From Algorithms to Applications", Academic Press