Parameter overview

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The table below gives a overview over all the model and parameter settings which is available.

The table below lists all options + the units used for each

 

Nr

ValueType

Units

Type

Description

 

Component: Name

[-]

String

Name of the component

 

1

 

Component: Type

 

[-]

 

numerical

Sets the type of component. Options for Value:

0: Standard component

1: Polymer

2

 

Component: IsAlkane

 

[-]

 

Numeric

Alkane or non-Alkane. Options for Value:

0: Alkane

1: non-Alkane

3

Component: DBIndex

[-]

Numeric

Internal use. Indicate the VLXE database index

5

Standard: Tc

[Kelvin]

Numeric

Critical temperature

6

Standard: Pc

[Bar]

Numeric

Critical pressure

7

Standard: Vc

[cm3/mol]

Numeric

Critical volume

8

Standard: AcentricFactor

[-]

Numeric

Acentric factor

9

Standard: HeatOfFormation

[kJ/kg]

Numeric

Heat of formation for the component

10

CpIGPoly

[kJ/kg]

Numeric

Ideal gas Cp using a polynomial expression

11

CpIGDIPPR

[kJ/kg]

Numeric

Ideal gas Cp using a DIPPR expression

12

Monomer: Name

[-]

String

Name of the monomer that makes the block

13

Monomer: M

[g/mole]

Numeric

Molar mass of the monomer that makes the block

14

SLE: c

[-]

Numeric

Crystallinity fraction. Fraction of solid polymer that is in crystal form.

15

SLE: Hu

[J/mol]

Numeric

Enthalpy of melting of one mole of monomer

16

SLE: Dc

[g/cm3]

Numeric

Density of crystalline polymer

17

SLE: Da

[g/cm3]

Numeric

Density of amorphous polymer

18

SLE: Tss

[Kelvin]

Numeric

Solid/Solid transition temperature

19

SLE: Hss

[J/mol]

Numeric

Enthalpy of solid/solid transition

20

SLE: CpPoly

[kJ/(kg Kelvin)]

Numeric

Heat capacity of solid polymer

21

PCSAFT: dm

[mol/g]

Numeric

PC-SAFT parameter

22

PCSAFT: Sigma

[A]

Numeric

PC-SAFT parameter

23

PCSAFT: Epsilon

[Kelvin]

Numeric

PC-SAFT parameter

24

PCSAFT: VolumeShift

[cm3/g]

Numeric

PC-SAFT parameter.

 

25

 

Association: Use

 

[-]

 

Numeric

Turn association term on and off. Valid input:

0: On

1: Off

26

Association: Kappa

[-]

Numeric

Association term parameter

27

Association: Epsilon

[Kelvin]

Numeric

Association term parameter

28

Association: Scheme

[-]

String

Association term parameter

 

29

 

Polar: Use

 

[-]

 

Numeric

Turn polar term on and off. Valid input:

0: On

1: Off

30

Polar: x

[-]

Numeric

Polar term parameter

31

Polar: D

[D]

Numeric

Polar term parameter

32

MSL: dm

[mole/g]

Numeric

SL/MSL parameter

33

MSL: v

[cm3/mole]

Numeric

SL/MSL parameter

34

MSL: Epsilon

[Kelvin]

Numeric

SL/MSL parameter

35

MSL: VolumeShift

[cm3/g]

Numeric

SL/MSL parameter

36

EOSQ: VolumeShift

[cm3/g]

Numeric

PR/SRK parameter

37

Block: DBIndex

[-]

Numeric

Internal use. Indicate the VLXE database index for the block.

38

Block: MassFraction

[-]

Numeric

Massfraction of the block within the copolymer/component

39

Block: Name

[-]

String

Name of the block within the copolymer/component

40

SurfaceTension: IP

[J m^5/mol^2]

Numeric

Influence parameter used in surface tension

41

SurfaceTension: Parachor

[]

Numeric

W/K surface tension model parameter

42

Viscosity: Critical

[uP]

Numeric

f-theory viscosity parameter

43

Viscosity: Kz

[-]

Numeric

f-theory viscosity parameter