Here is a list of species provided by Engineering Software.
| AL(S)
AL(L) AL ALBO2 ALBR ALBR3(S) ALBR3(L) ALBR3 ALCL ALCLF ALCLF2 ALCL2 ALCL2F ALCL3(S) ALCL3(L) ALCL3 ALF ALF2 ALF3(S) ALF3(S) ALF3 ALH ALI ALI3(S) ALI3(L) ALI3 ALN(S) ALN ALO ALOCL ALOF ALOH ALO2 ALO2H AL2BR6 AL2CL6 AL2F6 AL2O AL2O2 AL2O3(S) AL2O3(L) AR B(S) B(L) B BCL BCLF BCL2 BCL3 BF BF2 BF3 BH BHF2 BH2 BH3 BN(S) BN BO BOCL BOF BOF2 BO2 BS B2 B2O B2O2 B2O3(L) B2O3 B3O3CL3 B3O3F3 BA(S) BA(S) BA(S) BA(L) BA BACL BACL2(S) BACL2(S) BACL2(L) BACL2 BAF BAF2(S) BAF2(S) BAF2(L) BAF2 BAO(S) BAO(L) BE(S) BE(L) BE BEBO2 BECL BECLF BECL2(S) BECL2(L) BECL2 BEF BEF2(S) BEF2(S) BEF2(L) BEF2 BEH BEN BEO(S) BEO(S) BEO(L) BEO BEOH BEO2H2 BE2O BE2OF2 BE2O2 BE3O3 BE4O4 BR BR2(L) BR2 C(S) C CCL CCL2 CCL3 CCL4 CF CF2 CF3 CF4 CH CH2 CH2O CH3 CH4 CN |
CNN
CN2 CO COCL COCL2 COF COF2 COS CO2 CP CS CS2 C2 C2CL2 C2F2 C2F4 C2H C2HF C2H2 C2H4 C2H6 C2N C2N2 C2O C3 C3O2 C4 C5 CA(S) CA(S) CA(L) CA CACO3(S) CACL CACL2(S) CACL2(L) CACL2 CAF CAF2(S) CAF2(S) CAF2(L) CAF2 CAO(S) CAO(L) CAOH CAO2H2(S) CAS(S) CL CLCN CLF CLF3 CLO CLO2 CL2 CL2O CR(S) CR(L) CR CS(S) CS(L) CS CSCL(S) CSCL(S) CSCL(L) CSCL CSF(S) CSF(L) CSF CSO CSOH(S) CSOH(S) CSOH(L) CSOH CS2 CS2CL2 CS2F2 CS2O CS2O2H2 F FCN FO FO2 F2 F2O FE(S) FE(S) FE(S) FE(L) FE FECL FECL2(S) FECL2(L) FECL2 FECL3(S) FECL3(L) FECL3 FEO(S) FEO(L) FEO FEO2H2(S) FEO2H2 FEO3H3(S) FE2CL4 FE2O3(S) FE3O4(S) H HALO HBO HBO2 HBR HCL HCN HCO HCP HF HI HNCO HNO HNO2 HNO3 HOF HO2 HSO3F H2 H2O(S) H2O(L) H2O H2O2 H2S H2SO4(L) H2SO4 H3B3O6 HE I |
I2(S)
I2(L) I2 K(S) K(L) K KBO2 KCL(S) KCL(L) KCL KF(S) KF(L) KF KHF2(S) KHF2(S) KHF2(L) K2F2 KO KOH KOH(S) KOH(S) KOH(L) K2 K2CO3(S) K2CO3(L) K2O(S) K2O2H2 K2SO4(S) K2SO4(S) K2SO4(L) LI(S) LI(L) LI LIBO2 LICL(S) LICL(L) LICL LIF(S) LIF(L) LIF LIFO LIH(S) LIH(L) LIH LIN LIO LIOH(S) LIOH(L) LIOH LION LI2 LI2CL2 LI2F2 LI2O(S) LI2O(L) LI2O LI2O2 LI2O2H2 LI3CL3 LI3F3 MG(S) MG(L) MG MGAL2O4(S) MGAL2O4(L) MGCL MGCLF MGCL2(S) MGCL2(L) MGCL2 MGF MGF2(S) MGF2(L) MGF2 MGH MGN MGO(S) MGO(L) MGO MGOH MGO2H2 MGS(S) MGS MGSIO3(S) MGSIO3(S) MGSIO3(S) MGSIO3(L) MGSO4(S) MGSO4(L) MG2SIO4(S) MG2SIO4(L) N NF NCO NF2 NF3 NH NH2 NH3 NO NOCL NOF NOF3 NO2CL NO2F NO2 NO3 N2 N2H4 N2O N2O4 N2O5 N3 NA(S) NA(L) NA NABO2 NACL(S) NACL(L) NACL NAF(S) NAF(L) NAF NABR(S) NABR(L) NABR NACN NAH NAI(S) NAI(L) NAI NAO NAOH(S) NAOH(L) |
NAOH
NA2 NA2CO3(S) NA2CO3(S) NA2CO3(L) NA2CL2 NA2F2 NA2O(S) NA2O(S) NA2O(L) NA2O2H2 NA2C2N2 NA2SO4(S) NA2SO4(S) NA2SO4(S) NA2SO4(L) NA2SO4 NB(S) NB(L) NB NB2O5(S) NB2O5(L) NE O OH O2 O3 P P(S) PCL3 PF3 PF5 PH PH3 PN PO PO2 PO3 PS P2 P4 P4O10(S) P4O10 PB(S) PB(L) PB PBCL PBCL2(S) PBCL2(L) PBCL2 PBF2 PBS(S) PBS(L) PBS PB2 S(S) S(L) S SF4 SF6 SH SN SO SOF2 SO2 SO2CL2 SO2CLF SO2F2 SO3 S2 S8 SI(S) SI(L) SI SIC SIC2 SICL SICL2 SICL3 SICL4 SIF SIF2 SIF3 SIF4 SIH SIH4 SIN SIO SIO2(S) SIO2(S) SIO2(S) SIO2(L) SIO2 SIS SI2 SI2C SI2N SI3 SR(S) SR(L) SR SRCL SRCL2(S) SRCL2(S) SRCL2(L) SRCL2 SRF SRF2(S) SRF2(L) SRF2 SRO(S) SRO(L) TA(S) TA(L) TA TA2O5(S) TA2O5(L) TI TIO2(S) TIO2(L) TIO2 TIC(S) TIC(L) TIOCL V(S) V(L) V V2O4(S) V2O4(S) V2O4(L) V2O5(S) V2O5(L) XE AIR |
For each reaction species, the thermodynamic functions specific heat, enthalpy
and entropy as
functions of temperature are given in the form of least squares
coefficients as follows:
Cp/R = A1 + A2T + A3T2 + A4T3 + A5T4
H/(R*T) = A1 + A2T/2 + A3T2/3 + A4T3/4 + A5T4/5 + A6/T
S/R = A1lnT + A2T + A3T2/2 + A4T3/3 + A5T4/4 + A7
or
S/R = A1lnT + A2T + A3T2/2 + A4T3/3 + A5T4/4 + A7 - lnp
For each species, two sets of coefficients are included for two
adjecent temperature intervals, 273 to 1,000 [K]
and 1,000 to 5,000 [K]. The
data have been constrained to be equal at 1,000 [K].
