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  • ANEXOS: CAMBIAN TEMPERATURA Y PRESION

    Enviado por

    Wilma Yola Mamani
    17 visualizações5 páginas
    1. The document describes the equilibrium phases and species amounts for a system with oxygen, copper, liquid water, mercury oxide, and copper at different temperatures and pressures. 2. It provides the species amounts, fractions, and potentials for each phase at 298.15K and 0.66 bar, then again at 323.15K and 0.66 bar. 3. The minimum Gibbs free energy, enthalpy changes, and cell voltages are calculated for each condition. Errors in the Lagrange multipliers are also shown.

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    ANEXOS

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    1. The document describes the equilibrium phases and species amounts for a system with oxygen, copper, liquid water, mercury oxide, and copper at different temperatures and pressures. 2. It provides the species amounts, fractions, and potentials for each phase at 298.15K and 0.66 bar, then again at 323.15K and 0.66 bar. 3. The minimum Gibbs free energy, enthalpy changes, and cell voltages are calculated for each condition. Errors in the Lagrange multipliers are also shown.

    Direitos autorais:

    © All Rights Reserved
    Baixe no formato DOCX, PDF, TXT ou leia online no Scribd
    Sinalizar o conteúdo como inadequado
    17 visualizações5 páginas

    ANEXOS: CAMBIAN TEMPERATURA Y PRESION

    Enviado por

    Wilma Yola Mamani
    1. The document describes the equilibrium phases and species amounts for a system with oxygen, copper, liquid water, mercury oxide, and copper at different temperatures and pressures. 2. It provides the species amounts, fractions, and potentials for each phase at 298.15K and 0.66 bar, then again at 323.15K and 0.66 bar. 3. The minimum Gibbs free energy, enthalpy changes, and cell voltages are calculated for each condition. Errors in the Lagrange multipliers are also shown.

    Direitos autorais:

    © All Rights Reserved
    Baixe no formato DOCX, PDF, TXT ou leia online no Scribd
    Sinalizar o conteúdo como inadequado
    de 5

    ANEXOS: CAMBIAN

    Cambiando DO PRESION Y TEMPERATURA


    Gas(Oxygen)---- Metal(Copper)----Liquid(PHASE 3:)----Solid(Mercuryoxide)---Metal(Copper)
    Temperature: 298.150000 K
    Pressure: 0.660000 bar
    # 1 phase: Gas (Oxygen)
    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    O2(g) 2.240E+0001 2.240E+0001 1.000E+0000 0.00 0.00
    -----------------------------------------------------------------------------
    Total: 22.400000
    # 2 phase: Metal(Copper)
    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    Cu 1.000E+0001 1.000E+0001 1.000E+0000 0.00 -0.00
    e-(Cu) 0.000E+0000-1.725E-0011 -1.725E-0012 -20259.00 -33612.73
    -----------------------------------------------------------------------------
    Total: 10.000000
    # 3 phase: Liquid(PHASE 3:)
    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    H2O 5.550E+0001 5.550E+0001 7.986E-0001 -237698.59 -237698.59
    H(+a) 1.000E-0017 1.165E-0015 1.165E-0015 -85236.57 -85236.70
    OH(-a) 7.000E+0000 7.000E+0000 7.001E+0000 -152462.03 -152462.03
    K(+a) 7.000E+0000 7.000E+0000 7.001E+0000 -277668.03 -277668.03
    -----------------------------------------------------------------------------
    Total: 69.500000
    # 4 phase: Metal(Mercury)
    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    Hg 0.000 0.000E+0000
    -----------------------------------------------------------------------------
    Total: 0.000000
    # 5 phase: Solid(Mercuryoxide)
    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    HgO 1.000E-0017 1.000E-0017 1.000E+0000 -58575.00 -58575.00
    -----------------------------------------------------------------------------
    Total: 0.000000
    # 6 phase: Metal(Copper)
    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    Cu 1.000E+0001 1.000E+0001 1.000E+0000 0.00 -0.00
    e-(Cu) 0.000E+0000 3.052E-0018 3.052E-0019 -20259.00 -20259.00
    -----------------------------------------------------------------------------
    Total: 10.000000
    Minimum value of G = -16203182.36971
    Enthalpy of input ..... H(A) = -0.9045 kJ
    Enthalpy of equilibrium H(B) = -19.2389 kJ
    Delta H = H(B) - H(A) = -18.3344 kJ
    Volta potentials in the metal,semiconductor and liquid phases
    -------------------------------------------------------------
    Metal(Copper) 0.13840 V
    Metal(Mercury) 0.00000 V
    Metal(Copper) -0.00000 V
    Cell voltage U = 0.13840 V
    Liquid(PHASE 3:) 0.00000 V
    Errors in Ax = b Lagrange multipliers/RT
    -----------------------------------------------------
    #1 0.00000E+0000 10.77426920713333
    #2 0.00000E+0000 -0.00000000000000
    # 3 -1.57857E-0020 -8.17284331734118
    #4 0.00000E+0000 42.55880550423171
    #5 0.00000E+0000 120.18910939176567
    #6 0.00000E+0000 12.85593730675464
    #7 0.00000E+0000 5.38713460356666
    #8 0.00000E+0000 0.00000000000000

    Gas(Oxygen)---- Metal(Copper)----Liquid(PHASE 3:)----Solid(Mercuryoxide)---Metal(Copper)


    Temperature: 323.150000 K
    Pressure: 0.660000 bar

    # 1 phase: Gas (Oxygen)


    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    O2(g) 2.240E+0001 2.240E+0001 1.000E+0000 0.00 0.00
    -----------------------------------------------------------------------------
    Total: 22.400000
    # 2 phase: Metal (Copper)
    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    Cu 1.000E+0001 1.000E+0001 1.000E+0000 0.00 -0.00
    e-(Cu) 0.000E+0000-1.631E-0011 -1.631E-0012 -20259.00 -32882.86
    -----------------------------------------------------------------------------
    Total: 10.000000
    # 3 phase: Liquido (PHASE 3:)
    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    H2O 5.550E+0001 5.550E+0001 7.986E-0001 -237443.35 -237443.35
    H(+a) 1.000E-0017 1.331E-0014 1.331E-0014 -85838.82 -85839.29
    OH(-a) 7.000E+0000 7.000E+0000 7.001E+0000 -151604.53 -151604.53
    K(+a) 7.000E+0000 7.000E+0000 7.001E+0000 -277452.53 -277452.53
    -----------------------------------------------------------------------------
    Total: 69.500000
    # 4 phase: Metal (Mercury)
    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    Hg 0.000 0.000E+0000
    -----------------------------------------------------------------------------
    Total: 0.000000
    # 5 phase: Solid(Mercuryoxide)
    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    HgO 1.000E-0017 1.000E-0017 1.000E+0000 -58374.00 -58374.00
    -----------------------------------------------------------------------------
    Total: 0.000000
    # 6 phase: Metal(Copper)
    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    Cu 1.000E+0001 1.000E+0001 1.000E+0000 0.00 -0.00
    e-(Cu) 0.000E+0000 3.225E-0018 3.225E-0019 -20259.00 -20259.00
    -----------------------------------------------------------------------------
    Total: 10.000000
    Minimum value of G = -16181505.35610
    Enthalpy of input ..... H(A) = -2.7134 kJ
    Enthalpy of equilibrium H(B) = -19.2097 kJ
    Delta H = H(B) - H(A) = -16.4963 kJ
    Volta potentials in the metal,semiconductor and liquid phases
    -------------------------------------------------------------
    Metal(Copper) 0.13083 V
    Metal(Mercury) 0.00000 V
    Metal(Copper) -0.00000 V
    Cell voltage U = 0.13083 V
    Liquid(PHASE 3:) 0.00000 V
    Errors in Ax = b Lagrange multipliers/RT
    -----------------------------------------------------
    #1 0.00000E+0000 9.39740469037497
    #2 0.00000E+0000 -0.00000000000000
    # 3 -1.89661E-0019 -7.54056146107905
    #4 0.00000E+0000 39.49045754934195
    #5 0.00000E+0000 110.81062051677145
    #6 0.00000E+0000 12.32986647968937
    #7 0.00000E+0000 4.69870234518748
    #8 0.00000E+0000 0.00000000000000

    Gas(Oxygen)---- Metal(Copper)----Liquid(PHASE 3:)----Solid(Mercuryoxide)---Metal(Copper)


    Temperature: 298.150000 K
    Pressure: 1.000000 bar

    # 1 phase: Gas(Oxygen)
    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    O2(g) 2.240E+0001 2.240E+0001 1.000E+0000 0.00 0.00
    -----------------------------------------------------------------------------
    Total: 22.400000
    # 2 phase: Metal(Copper)
    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    Cu 1.000E+0001 1.000E+0001 1.000E+0000 0.00 -0.00
    e-(Cu) 0.000E+0000-1.725E-0011 -1.725E-0012 -20259.00 -33612.73
    -----------------------------------------------------------------------------
    Total: 10.000000
    # 3 phase: Liquid(PHASE 3:)
    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    H2O 5.550E+0001 5.550E+0001 7.986E-0001 -237698.59 -237698.59
    H(+a) 1.000E-0017 1.165E-0015 1.165E-0015 -85236.57 -85236.70
    OH(-a) 7.000E+0000 7.000E+0000 7.001E+0000 -152462.03 -152462.03
    K(+a) 7.000E+0000 7.000E+0000 7.001E+0000 -277668.03 -277668.03
    -----------------------------------------------------------------------------
    Total: 69.500000
    # 4 phase: Metal(Mercury)
    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    Hg 0.000 0.000E+0000
    -----------------------------------------------------------------------------
    Total: 0.000000
    # 5 phase: Solid(Mercuryoxide)
    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    HgO 1.000E-0017 1.000E-0017 1.000E+0000 -58575.00 -58575.00
    -----------------------------------------------------------------------------
    Total: 0.000000
    # 6 phase: Metal(Copper)
    Input Equil.
    Species amount amount Fraction(Gas) Potential (J)
    Name Mol Mol /Molality(Aqua) Chemical Electrochem.
    -----------------------------------------------------------------------------
    Cu 1.000E+0001 1.000E+0001 1.000E+0000 0.00 -0.00
    e-(Cu) 0.000E+0000 3.052E-0018 3.052E-0019 -20259.00 -20259.00
    -----------------------------------------------------------------------------
    Total: 10.000000
    Minimum value of G = -16203182.36971
    Enthalpy of input ..... H(A) = -0.9045 kJ
    Enthalpy of equilibrium H(B) = -19.2389 kJ
    Delta H = H(B) - H(A) = -18.3344 kJ
    Volta potentials in the metal,semiconductor and liquid phases
    Metal(Copper) 0.13840 V
    Metal(Mercury) 0.00000 V
    Metal(Copper) -0.00000 V
    Cell voltage U = 0.13840 V
    Liquid(PHASE 3:) 0.00000 V
    Errors in Ax = b Lagrange multipliers/RT
    -----------------------------------------------------
    #1 0.00000E+0000 10.77426920713333
    #2 0.00000E+0000 -0.00000000000000
    # 3 -1.57857E-0020 -8.17284331734118
    #4 0.00000E+0000 42.55880550423171
    #5 0.00000E+0000 120.18910939176567
    #6 0.00000E+0000 12.85593730675464
    #7 0.00000E+0000 5.38713460356666
    #8 0.00000E+0000 0.00000000000000

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