• Title/Summary/Keyword: 과잉깁스에너지

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Study of Excess Gibbs Energy for a Lattice Solution by Random Number Simulation (난수 모의실험을 통한 격자용액의 과잉깁스에너지에 대한 고찰)

  • Jung, Hae-Young
    • Journal of the Korean Chemical Society
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    • v.51 no.4
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    • pp.312-317
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    • 2007
  • Performing random number simulations, we approximated that the distribution of the number of ways for arranging molecules randomly on a lattice is a normal distributon for N12, the number of interactions between the nearest neighbors of different molecules. From this distribution, an approximate equation of the excess Gibbs energy GE for a lattice solution of nonrandom mixing was derived. Using the equation, liquid-vapor equilibria of several binary solutions were calculated and compared with the calculated result of other equations.

Gibbs Energy of Nonrandomly Mixed Lattice Solutions with a Specific Interaction (특정 상호작용을 갖는 논랜덤 혼합 격자 용액의 깁스 에너지)

  • Jung, Hae-Young
    • Journal of the Korean Chemical Society
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    • v.53 no.6
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    • pp.663-670
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    • 2009
  • Performing random number simulations, we obtained an approximate distribution of the number of ways arranging molecules in a binary lattice solution of nonrandom mixing with a specific interaction. From the distribution an approximate equation of excess Gibbs energy for a binary lattice solution was derived. Using the equation, liquid-vapor equilibrium at constant pressure for 15 binary solutions were calculated and compared with the result from Wilson equation, Van Laar equation and Redlich-Kister equation.