Difference between revisions of "Mixed Solvent Electrolyte ( MSE) model Regression Parameters"

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(Created page with "OLI Tips #46 Mixed Solvent Electrolyte (MSE) model Regression Parameters The regression parameters for each variable are Bold-faced K-VALUE COEFFICIENTS A, B, C, D K-VALUE ...")
 
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K-VALUE COEFFICIENTS A, B, C, D
+
 
K-VALUE COEFFICIENTS E, F, G
+
 
BROMLEY B1, B2, B3
+
* K-VALUE COEFFICIENTS '''A, B, C, D'''
BROMLEY C1, C2, C3
+
* K-VALUE COEFFICIENTS '''E, F, G'''
BROMLEY D1, D2, D3
+
* BROMLEY '''B1, B2, B3'''
PITZER BETA0(1), BETA0(2), BETA0(3)  (B01,B02,B03)
+
* BROMLEY '''C1, C2, C3'''
PITZER BETA1(1), BETA1(2), BETA1(3)  (B11,B12,B13)
+
* BROMLEY '''D1, D2, D3'''
REACTION KINETICS AF, BF, AR, BR
+
* PITZER BETA0(1), BETA0(2), BETA0(3)  '''(B01,B02,B03)'''
REACTION KINETICS ER1, ER2, ..., ER10
+
* PITZER BETA1(1), BETA1(2), BETA1(3)  '''(B11,B12,B13)'''
REACTION KINETICS EP1, EP2, ..., EP10
+
* REACTION KINETICS '''AF, BF, AR, BR'''
ION EXCHANGE, BEX1
+
* REACTION KINETICS '''ER1, ER2, ..., ER10'''
ION EXCHANGE, AIJ, AJI, DIJ
+
* REACTION KINETICS '''EP1, EP2, ..., EP10'''
SRK KIJ, GIJ
+
* ION EXCHANGE, '''BEX1'''
SRK KIJ0, KIJ1, KIJ2  (KIJ0 IS EQUIVALENT TO KIJ (NO. 56))
+
* ION EXCHANGE, '''AIJ, AJI, DIJ'''
PITZER DENSITY BETA0(1), BETA0(2), BETA0(3)  (BD01,BD02,BD03)
+
* SRK '''KIJ, GIJ'''
PITZER DENSITY BETA1(1), BETA1(2), BETA1(3)  (BD11,BD12,BD13)
+
* SRK '''KIJ0, KIJ1, KIJ2''' (KIJ0 IS EQUIVALENT TO KIJ (NO. 56))
HELG HW,HA1,HA2,HA3,HA4,HC1,HC2,GREF,SREF,HREF
+
* PITZER DENSITY BETA0(1), BETA0(2), BETA0(3)  '''(BD01,BD02,BD03)'''
 +
* PITZER DENSITY BETA1(1), BETA1(2), BETA1(3)  '''(BD11,BD12,BD13)'''
 +
* HELG '''HW,HA1,HA2,HA3,HA4,HC1,HC2,GREF,SREF,HREF'''
  
 
Mix Solvent UNIQAC
 
Mix Solvent UNIQAC

Revision as of 14:07, 24 June 2014

OLI Tips #46 Mixed Solvent Electrolyte (MSE) model Regression Parameters

The regression parameters for each variable are Bold-faced



  • K-VALUE COEFFICIENTS A, B, C, D
  • K-VALUE COEFFICIENTS E, F, G
  • BROMLEY B1, B2, B3
  • BROMLEY C1, C2, C3
  • BROMLEY D1, D2, D3
  • PITZER BETA0(1), BETA0(2), BETA0(3) (B01,B02,B03)
  • PITZER BETA1(1), BETA1(2), BETA1(3) (B11,B12,B13)
  • REACTION KINETICS AF, BF, AR, BR
  • REACTION KINETICS ER1, ER2, ..., ER10
  • REACTION KINETICS EP1, EP2, ..., EP10
  • ION EXCHANGE, BEX1
  • ION EXCHANGE, AIJ, AJI, DIJ
  • SRK KIJ, GIJ
  • SRK KIJ0, KIJ1, KIJ2 (KIJ0 IS EQUIVALENT TO KIJ (NO. 56))
  • PITZER DENSITY BETA0(1), BETA0(2), BETA0(3) (BD01,BD02,BD03)
  • PITZER DENSITY BETA1(1), BETA1(2), BETA1(3) (BD11,BD12,BD13)
  • HELG HW,HA1,HA2,HA3,HA4,HC1,HC2,GREF,SREF,HREF

Mix Solvent UNIQAC

Q0IJ,Q0JI Q1IJ,Q1JI Q2IJ,Q2JI Q3IJ,Q3JI Q4IJ,Q4JI


Mix Solvent MID-RANGE BMD0 BMD1 BMD2 CMD0 CMD1 CMD2 CMD3 CMD4 BMD3 BMD4


Full Pitzer Framework (Hanford)

Binaries beta(0) = PB01, PB02, ..., PB08 beta(1) = PB11, PB12, ..., PB18 beta(0) = PB21, PB22, ..., PB28 C(0) = PC01, PC02, ..., PC08

Ternaries/Binaries lambda = PLAM1, PLAM2, ..., PLAM6 theta = PTHE1, PTHE2, ..., PTHE6 psi = PPSI1, PPSI2, ..., PPSI6


Mix Solvent UNIQAC Density D0IJ,D0JI D1IJ,D1JI D2IJ,D2JI

Mix Solvent Mid Range Density

DMD1 DMD2 DMD3 DMD4 DMD5 DMD6 DMD7 DMD8 DMD9 DMD0


Solid CP, G, H, S AND V CP

CPS1 CPS2 CPS3 CPS4 CPS5 G, H, S, and V GRFS HRFS SRFS VRFS

Dielectric Constant

DIE0 DIE1 DIE2 DIE3

UNIQ R & Q R_UQ Q_UQ

Vapor CP, G and H CPI1 JOULE/K/MOL CPI2 CPI3 CPI4 CPI5 GRFV CAL/MOL HRFV CAL/MOL SRFV CAL/MOL/K