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puran-water

Corrosion Engineering MCP Server

by puran-water
SS316.m5.18 kB
classdef SS316 < corrodingMetal & handle %SS316 Summary of this class goes here % Detailed explanation goes here properties end methods function obj = SS316(name,ccl,T,pH) %corrodingMetal Construct an instance of this class % Detailed explanation goes here obj.Name = name; obj.cCl = ccl; obj.T = T; obj.pH = pH; obj.MetalMass = 51.9961; %Molar mass of Cr, g/mol obj.OxidationLevelZ = 3; %Cr -> Cr3+ + 3e- % obj.DoesPit int32 obj.PitPotential = -0.2; %VSCE obj.DeltaGMetalPitting = obj.CalculateDeltaG('Pitting',obj.cCl,obj.pH,obj.T); obj.BetaMetalPitting = 0.9999; obj.DeltaGMetalPassivation = obj.CalculateDeltaG('Passivation',obj.cCl,obj.pH,obj.T); obj.BetaMetalPassivation = 0.6; %0.21; obj.DeltaGORR = obj.CalculateDeltaG('ORR',obj.cCl,obj.pH,obj.T); obj.BetaORR = 0.89; obj.delORR = 0.085; %cm obj.DeltaGHER = obj.CalculateDeltaG('HER',obj.cCl,obj.pH,obj.T); obj.BetaHER = 0.8; obj.delHER = 0.15; %cm obj.OxideMass = 151.99; %g/mol obj.OxideDensity = 5.22; %g/cm3 obj.ResistivityOfOxide = 5000.0e9; %Ohm/cm obj.PassiveCurrentDensity = 1.0e-3; %A/cm2 obj.PassiveFilmThickness = 2.5e-7; %cm end function actEnergies = CalculateDeltaG(obj,whichBarrier,ccl,ph,T) pHmax = 13; pHmin = 1; switch whichBarrier case 'ORR' %Expression to predict dG_cathodic without pH %dependence data = readmatrix('SS316ORRCoeffs.csv'); p00 = data(1); p10 = data(2); p01 = data(3); p20 = data(4); p11 = data(5); p02 = data(6); dgCathodic_nopH = p00 + p10*ccl + p01*T + p20*ccl^2 + p11*ccl*T + p02*T^2; dGCmax = 1.1*dgCathodic_nopH; dGCmin = 0.9*dgCathodic_nopH; m = (dGCmin-dGCmax)/(pHmax-pHmin); dgCathodic = m*(ph-pHmax) + dGCmin; dgAnodic = 800.0e4; case 'HER' %Expression to predict dG_cathodic without pH %dependence data = readmatrix('SS316HERCoeffs.csv'); p00 = data(1); p10 = data(2); p01 = data(3); p20 = data(4); p11 = data(5); p02 = data(6); dgCathodic_nopH = p00 + p10*ccl + p01*T + p20*ccl^2 + p11*ccl*T + p02*T^2; dGCmax = 1.1*dgCathodic_nopH; dGCmin = 0.9*dgCathodic_nopH; m = (dGCmin-dGCmax)/(pHmax-pHmin); dgCathodic = m*(ph-pHmax) + dGCmin; dgAnodic = 1000.0e4; case 'Oxidation' dgAnodic = 0.0; dgCathodic = 0.0; case 'Passivation' %Expression to predict dG_anodic without pH %dependence data = readmatrix('SS316PassCoeffs.csv'); p00 = data(1); p10 = data(2); p01 = data(3); p20 = data(4); p11 = data(5); p02 = data(6); dgAnodic_nopH = p00 + p10*ccl + p01*T + p20*ccl^2 + p11*ccl*T + p02*T^2; dGAmax = 1.1*dgAnodic_nopH; dGAmin = 0.9*dgAnodic_nopH; m = (dGAmin-dGAmax)/(pHmax-pHmin); dgAnodic = m*(ph-pHmax) + dGAmin; dgCathodic = 100.0e4; %15.0e4; case 'Pitting' %Expression to predict dG_cathodic without pH %dependence data = readmatrix('SS316PitCoeffs.csv'); p00 = data(1); p10 = data(2); p01 = data(3); p20 = data(4); p11 = data(5); p02 = data(6); dgAnodic_nopH = p00 + p10*ccl + p01*T + p20*ccl^2 + p11*ccl*T + p02*T^2; dGAmax = 1.1*dgAnodic_nopH; dGAmin = 0.9*dgAnodic_nopH; m = (dGAmax-dGAmin)/(pHmax-pHmin); dgAnodic = m*(ph-pHmin) + dGAmin; dgCathodic = 20.0e4; end actEnergies = [dgCathodic,dgAnodic]; end end end

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