Number of elements = 3
 chem pot = -2.3e+07
dg_corr = -1.57754e+08
um_li_chempot = -1.65555e+08
Trying VCS equilibrium solver
Unknown Cantera EOS to VCSnonideal: 'Margules'
Unknown Cantera EOS to VCSnonideal: 'compound-lattice'

================================================================================
================ Cantera_to_vprob: START OF PROBLEM STATEMENT ====================
================================================================================
             Phase IDs of species
            species     phaseID        phaseName    Initial_Estimated_kMols
         LiCl(L)          0   MoltenSalt_electrolyte             7         
          KCl(L)          0   MoltenSalt_electrolyte             3         
       Li7Si3(S)          1   Li7Si3_and_Interstitials(S)             0.5       
           Li(i)          1   Li7Si3_and_Interstitials(S)             0.005     
            V(i)          1   Li7Si3_and_Interstitials(S)             0.495     
         LiFixed          2            LiFixed             100       

--------------------------------------------------------------------------------
             Information about phases
  PhaseName    PhaseNum SingSpec GasPhase EqnState NumSpec  TMolesInert       Tmoles(kmol)
MoltenSalt_electrolyte     0     0        0 UnkType:      -1        2     0.000000e+00     1.000000e+01
Li7Si3_and_Interstitials(S)     1     0        0 UnkType:      -1        3     0.000000e+00     1.000000e+00
         LiFixed     2     1        0       Stoich Sub        1     0.000000e+00     1.000000e+02

================================================================================
================ Cantera_to_vprob: END OF PROBLEM STATEMENT ====================
================================================================================


================================================================================
==================== Cantera_to_vprob: START OF PROBLEM STATEMENT ====================
================================================================================

             Phase IDs of species
            species     phaseID        phaseName    Initial_Estimated_kMols
         LiCl(L)          0   MoltenSalt_electrolyte             7         
          KCl(L)          0   MoltenSalt_electrolyte             3         
       Li7Si3(S)          1   Li7Si3_and_Interstitials(S)             0.5       
           Li(i)          1   Li7Si3_and_Interstitials(S)             0.005     
            V(i)          1   Li7Si3_and_Interstitials(S)             0.495     
         LiFixed          2            LiFixed             100       

--------------------------------------------------------------------------------
             Information about phases
  PhaseName    PhaseNum SingSpec GasPhase EqnState NumSpec  TMolesInert       Tmoles(kmol)
MoltenSalt_electrolyte     0     0        0 UnkType:      -1        2     0.000000e+00     1.000000e+01
Li7Si3_and_Interstitials(S)     1     0        0 UnkType:      -1        3     0.000000e+00     1.000000e+00
         LiFixed     2     1        0       Stoich Sub        1     0.000000e+00     1.000000e+02

================================================================================
==================== Cantera_to_vprob: END OF PROBLEM STATEMENT ====================
================================================================================


================================================================================
==================== VCS_PROB: PROBLEM STATEMENT ===============================
================================================================================

	Solve a constant T, P problem:
		T    = 625.15 K
		Pres = 1 atm

             Phase IDs of species
            species     phaseID        phaseName    Initial_Estimated_Moles   Species_Type
         LiCl(L)          0   MoltenSalt_electrolyte             7                          Mol_Num
          KCl(L)          0   MoltenSalt_electrolyte             3                          Mol_Num
       Li7Si3(S)          1   Li7Si3_and_Interstitials(S)             0.5                        Mol_Num
           Li(i)          1   Li7Si3_and_Interstitials(S)             0.005                      Mol_Num
            V(i)          1   Li7Si3_and_Interstitials(S)             0.495                      Mol_Num
         LiFixed          2            LiFixed             100                        Mol_Num

--------------------------------------------------------------------------------
             Information about phases
  PhaseName    PhaseNum SingSpec  GasPhase    EqnState    NumSpec  TMolesInert      TKmoles
MoltenSalt_electrolyte     0     0        0 UnkType:      -1        2     0.000000e+00     1.000000e+01
Li7Si3_and_Interstitials(S)     1     0        0 UnkType:      -1        3     0.000000e+00     1.000000e+00
         LiFixed     2     1        0       Stoich Sub        1     0.000000e+00     1.000000e+02

Elemental Abundances:             Target_kmol    ElemType ElActive
                          Li  1.105050000000E+02    0         1
                          K   3.000000000000E+00    0         1
                          Cl  1.000000000000E+01    0         1
                          Si  1.500000000000E+00    0         1
                          LC  0.000000000000E+00    3         1

Chemical Potentials:  (J/kmol)
             Species       (phase)        SS0ChemPot       StarChemPot
         LiCl(L) MoltenSalt_electrolyte    -4.46691e+08       -4.46691e+08
          KCl(L)                     -4.85963e+08       -4.85963e+08
       Li7Si3(S) Li7Si3_and_Interstitials(S)     -4.2014e+08        -4.2014e+08
           Li(i)                     -1.52202e+07       -1.52202e+07
            V(i)                            89800              89800
         LiFixed          LiFixed    -1.65555e+08       -1.65555e+08

================================================================================
==================== VCS_PROB: END OF PROBLEM STATEMENT ========================
================================================================================

VCS CALCULATION METHOD

 MultiPhase Object


    6 SPECIES
    5 ELEMENTS
    5 COMPONENTS
    3 PHASES
 PRESSURE                101325 Pa 
 TEMPERATURE            625.150 K
 PHASE1 INERTS            0.000
 PHASE2 INERTS            0.000

 ELEMENTAL ABUNDANCES             CORRECT          FROM ESTIMATE           Type

                          Li  1.105050000000E+02  1.105050000000E+02       0
                          K   3.000000000000E+00  3.000000000000E+00       0
                          Cl  1.000000000000E+01  1.000000000000E+01       0
                          Si  1.500000000000E+00  1.500000000000E+00       0
                          LC  0.000000000000E+00 -4.336808689942E-18       3

 USER ESTIMATE OF EQUILIBRIUM
 Stan. Chem. Pot. in J/kmol

 SPECIES            FORMULA VECTOR                                               STAN_CHEM_POT  EQUILIBRIUM_EST.  Species_Type

                    Li      K       Cl      Si      LC_1       PhaseID
 LiFixed            1       0       0       0       0          2                 -1.65555E+08   1.00000E+02       Mol_Num
 LiCl(L)            1       0       1       0       0          0                 -4.46691E+08   7.00000E+00       Mol_Num
 KCl(L)             0       1       1       0       0          0                 -4.85963E+08   3.00000E+00       Mol_Num
 Li7Si3(S)          7       0       0       3      -1          1                 -4.20140E+08   5.00000E-01       Mol_Num
 V(i)               0       0       0       0       1          1                  8.98000E+04   4.95000E-01       Mol_Num
 Li(i)              1       0       0       0       1          1                 -1.52202E+07   5.00000E-03       Mol_Num




--------------------------------------------------------------------------------
--------------------------------------------------------------------------------
		 VCS_TP REPORT
--------------------------------------------------------------------------------
--------------------------------------------------------------------------------
		Temperature  =         6.3e+02 Kelvin
		Pressure     =      1.0132e+05 Pa 
		total Volume =          1.6501 m**3


--------------------------------------------------------------------------------
 Species                 Equilibrium kmoles   Mole Fraction    ChemPot/RT    SpecUnkType
--------------------------------------------------------------------------------
 LiFixed                   1.0000500E+02      1.0000000E+00     -3.1851E+01     0
 LiCl(L)                   7.0000000E+00      7.0000000E-01     -8.6601E+01     0
 KCl(L)                    3.0000000E+00      3.0000000E-01     -9.6036E+01     0
 Li7Si3(S)                 5.0000000E-01      5.0000000E-01     -8.1524E+01     0
 V(i)                      5.0000000E-01      5.0000000E-01     -6.7587E-01     0
 Li(i)                     1.3977264E-13      1.3977264E-13     -3.2527E+01  KMolNum 
--------------------------------------------------------------------------------


-----------------------------------------------------------------------------------------------
               |ComponentID|          0          1          2          3          4 |           |
               | Components|    LiFixed    LiCl(L)     KCl(L)  Li7Si3(S)       V(i) |           |
 NonComponent  |   Moles   |        100          7          3        0.5        0.5 | DG/RT Rxn |
-----------------------------------------------------------------------------------------------
   5 Li(i)     |   1.4e-13 |      -1.00       0.00       0.00       0.00      -1.00 |  6.66e-16 |
-----------------------------------------------------------------------------------------------




------------------------------------------------------------------------------------------------------------
                  | ElementID |          0          1          2          3          4 |                     |
                  | Element   |         Li          K         Cl         Si LC_1_Li7Si |                     |
    PhaseName     |KMolTarget |        111          3         10        1.5          0 |     Gibbs Total     |
------------------------------------------------------------------------------------------------------------
   0 MoltenSalt_e | 1.000e+01 |          7          3         10          0          0 | -8.94317803632E+02 |
   1 Li7Si3_and_I | 1.000e+00 |        3.5          0          0        1.5  -4.43e-18 | -4.10998328109E+01 |
   2 LiFixed      | 1.000e+02 |        100          0          0          0          0 | -3.18526811529E+03 |
------------------------------------------------------------------------------------------------------------
    TOTAL         | 1.110e+02 |        111          3         10        1.5  -4.43e-18 | -4.12068575173E+03 |
------------------------------------------------------------------------------------------------------------


	Total Dimensionless Gibbs Free Energy = G/RT =  -4.1206858E+03

Elemental Abundances (kmol):          Actual                    Target         Type      ElActive
                          Li  1.105050000000E+02    1.105050000000E+02     0       1
                          K   3.000000000000E+00    3.000000000000E+00     0       1
                          Cl  1.000000000000E+01    1.000000000000E+01     0       1
                          Si  1.500000000000E+00    1.500000000000E+00     0       1
                          LC -4.434610288441E-18    0.000000000000E+00     3       1


---------------------------------------------------------------------------------------------
Chemical Potentials of the Species: (dimensionless)
		(RT = 5.19779e+06 J/kmol)
    Name        TKMoles     StandStateChemPot      ln(AC)       ln(X_i)      |   F z_i phi   |    ChemPot    | (-lnMnaught)|  (MolNum ChemPot)|
---------------------------------------------------------------------------------------------------------------------------------------------------
 LiFixed       1.0000500E+02 -3.1851089E+01   0.0000000E+00   0.0000000E+00  | 0.0000000E+00 |   -3.1851E+01 |             |      -3.185268115E+03 |
 LiCl(L)       7.0000000E+00 -8.5938686E+01  -3.0594111E-01  -3.5667494E-01  | 0.0000000E+00 |   -8.6601E+01 |             |      -6.062091156E+02 |
 KCl(L)        3.0000000E+00 -9.3494309E+01  -1.3379472E+00  -1.2039728E+00  | 0.0000000E+00 |   -9.6036E+01 |             |      -2.881086881E+02 |
 Li7Si3(S)     5.0000000E-01 -8.0830648E+01   0.0000000E+00  -6.9314718E-01  | 0.0000000E+00 |   -8.1524E+01 |             |      -4.076189751E+01 |
 V(i)          5.0000000E-01  1.7276586E-02   0.0000000E+00  -6.9314718E-01  | 0.0000000E+00 |   -6.7587E-01 |             |      -3.379352975E-01 |
 Li(i)         1.3977264E-13 -2.9281999E+00   0.0000000E+00  -2.9598759E+01  | 0.0000000E+00 |   -3.2527E+01 |             |      -4.546379094E-12 |
                                                                                                                                  -4.120685752E+03
---------------------------------------------------------------------------------------------------------------------------------------------------


Counters:         Iterations          Time (seconds)
    vcs_basopt:       1                 NA     
    vcs_TP:           3                 NA     
--------------------------------------------------------------------------------
--------------------------------------------------------------------------------

TCounters:   Num_Calls   Total_Its       Total_Time (seconds)
    vcs_basopt:       1          1             NA     
    vcs_TP:           1          3             NA     
    vcs_inest:        0                        NA     
    vcs_TotalTime:                             NA     

 Results from vcs:

Temperature = 625.15 Kelvin
Pressure    = 101325 Pa

-------------------------------------------------------------
 Name             Mole_Number(kmol)  Mole_Fraction     Chem_Potential (J/kmol)
-------------------------------------------------------------
LiCl(L)             7.000e+00         7.000e-01       -4.501e+08
KCl(L)              3.000e+00         3.000e-01       -4.992e+08
Li7Si3(S)           5.000e-01         5.000e-01       -4.201e+08
Li(i)               1.398e-13         1.398e-13       -1.655e+08
V(i)                5.000e-01         5.000e-01        8.980e+04
LiFixed             1.000e+02         1.000e+00       -1.656e+08
-------------------------------------------------------------
VCS solver succeeded
*************** MoltenSalt_electrolyte *****************
Moles: 10

  MoltenSalt_electrolyte:

       temperature   625.15 K
          pressure   1.0132e+05 Pa
           density   2042 kg/m^3
  mean mol. weight   52.037 kg/kmol
   phase of matter   unspecified

                          1 kg             1 kmol     
                     ---------------   ---------------
          enthalpy        -7.385e+06        -3.843e+08  J
   internal energy       -7.3851e+06        -3.843e+08  J
           entropy              2476        1.2885e+05  J/K
    Gibbs function       -8.9329e+06       -4.6485e+08  J
 heat capacity c_p            1331.7             69298  J/K
 heat capacity c_v            1171.9             60983  J/K

                      mass frac. Y      mole frac. X     chem. pot. / RT
                     ---------------   ---------------   ---------------
           LiCl(L)           0.57022               0.7           -86.601
            KCl(L)           0.42978               0.3           -96.036

*************** Li7Si3_and_Interstitials(S) *****************
Moles: 1

  Li7Si3_and_Interstitials(S):

       temperature   625.15 K
          pressure   1.0132e+05 Pa
           density   1390 kg/m^3
  mean mol. weight   66.418 kg/kmol
   phase of matter   solid

                          1 kg             1 kmol     
                     ---------------   ---------------
          enthalpy       -2.5008e+06       -1.6609e+08  J
   internal energy        -2.501e+06       -1.6611e+08  J
           entropy            6116.4        4.0623e+05  J/K
    Gibbs function       -6.3244e+06       -4.2005e+08  J
 heat capacity c_p            4197.1        2.7876e+05  J/K
 heat capacity c_v            4197.1        2.7876e+05  J/K

                      mass frac. Y      mole frac. X     chem. pot. / RT
                     ---------------   ---------------   ---------------
         Li7Si3(S)                 1               0.5           -80.831
             Li(i)        1.4605e-14        1.3977e-13           -31.834
              V(i)        7.5281e-23               0.5          0.017277

*************** LiFixed *****************
Moles: 100.005

  LiFixed:

       temperature   625.15 K
          pressure   1.0132e+05 Pa
           density   534 kg/m^3
  mean mol. weight   6.94 kg/kmol
   phase of matter   unspecified

                          1 kg             1 kmol     
                     ---------------   ---------------
          enthalpy       -2.3855e+07       -1.6556e+08  J
   internal energy       -2.3855e+07       -1.6556e+08  J
           entropy                 0                 0  J/K
    Gibbs function       -2.3855e+07       -1.6556e+08  J
 heat capacity c_p                 0                 0  J/K
 heat capacity c_v                 0                 0  J/K

                      mass frac. Y      mole frac. X     chem. pot. / RT
                     ---------------   ---------------   ---------------
           LiFixed                 1                 1           -31.851


