| comments are indicated by the | character. | check for warnings at the end of the header section. Berman & Aranovich 1996, Harrison & Sverjensky 2013, TWQ + DEW data base. |<= data base title begin_standard_variables |<= name (<9 characters), reference value, tolerance P(bars) 1.00 0.1E-3 T(K) 298.15 0.1E-4 Y(CO2) 0.00 0.1E-6 mu(C1) 0.00 0.1E-2 mu(C2) 0.00 0.1E-2 end_standard_variables tolerance -.1E-2 |<= DTOL for unconstrained minimization, energy units HSC_conversion |<= tag enabling HSC to GSC apparent energy conversion, requires elemental entropies in the component list below begin_components | < 6 chars, molar weight (g), elemental entropy (R) Na2O 61.9790 205.175 0 MgO 40.3040 135.255 0 Al2O3 101.9610 364.425 0 SiO2 60.0840 223.96 0 K2O 94.1960 231.935 0 CaO 56.0770 144.205 0 TiO2 79.8660 235.87 0 MnO 70.9370 134.795 0 FeO 71.8440 129.855 0 NiO 74.6930 132.375 0 ZrO2 123.2200 244.33 0 Cl2 70.9060 223.08 0 O2 31.9990 205.15 -4 H2O 18.0150 233.255 0 CO2 44.0100 210.89 0 CuO 79.5450 135.725 0 Cr2O3 151.9900 358.811 0 S2 64.1300 64.1 0 | Corrected 9/21/2018, Jilei Li. These values are twice the properties of monatomic sulfur. Formerly the monatomic molar wt was used with the diatomic formula. F2 37.9968 202.79 0 end_components WARNING!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! This is a copy of the TWQ data base, revision 1/96. In general the Gibbs energies of formation given in TWQ data bases do not appear to be consistent with the Enthalpies of formation, since PTAX/TWQ/etc do calculations using enthalpies of formation I assumed for purposes of conversion that the latter are correct, and Gibbs energies of formation were computed accordingly (see ubctover.f for details of conversion). The properties of ideal gas water have also been corrected. I have not checked that the phase abbreviations used in this file are consistent with earlier perplex data files. This means that you may have difficulties using the solution models in "solut.dat". It appears that the pyroxene formula unit has been changed from that used in earlier Berman/UBC data files. This may invalidate solution models in solut.dat based on the conventions used in earlier data files. This file includes phases that are not included in the the TWQ data base, if you use this data you should be aware that the data may not be considered valid by the authors of the TWQ data base. The phases added in this file are: da 1 0 0 0 fe_clinochlore czo 1 0 0 0 clinozoisite pwo 1 0 0 0 pseudowollastonite htr 1 0 0 0 high tridymite fparg 1 0 0 0 fepargasite parg 1 0 0 0 pargasite fts 1 0 0 0 amphibole fetschermakite ts 1 0 0 0 amphibole tschermakite ftr 1 0 0 0 fetremolite tr 1 0 0 0 tremolite fst 1 0 0 0 staurolite pmp 1 0 0 0 pumpellyite ne 1 0 2 0 nepheline m 1 0 0 0 magnesite from trommsdorff & connolly 89 mw 1 0 0 0 merwinite min 1 0 0 0 minnesotaite mo 1 0 0 0 monticellite blc 1 0 0 0 bleucite gru 1 0 0 0 grunerite gre 1 0 0 0 greenalite min 1 0 0 0 minnesotaite alc 1 0 1 0 aleucite glc 1 0 0 0 glaucophane pen 1 0 0 0 protoenstatite cen 1 0 0 0 clinoenstatite ep 1 0 0 0 epidote do 1 0 0 1 dolomite chl 1 0 0 0 clinochlore chr 1 0 0 0 chrysotile ant 1 0 0 0 antigorite br 1 0 0 0 brucite andr 1 0 0 0 andradite ak 1 0 1 0 akermanite mfer 1 0 1 0 magnesioferite from Ghiorso 93 sap 1 0 0 0 sapphirine JADC 11/96 end ab EoS = 1 | albite Na2O(.5)Al2O3(.5)SiO2(3) G0 = -3711715 S0 = 207.443 V0 = 10.043 c1 = 393.6357 c3 = -7892826 c5 = -2415.498 c7 = 1070636000 b2 = .2642032E-3 b4 = -.1953055E-4 b6 = .4882003E-10 b7 = .3254635E-7 end hab EoS = 1 | high albite Na2O(.5)Al2O3(.5)SiO2(3) G0 = -3703293 S0 = 224.412 V0 = 10.083 c1 = 393.6357 c3 = -7892826 c5 = -2415.498 c7 = 1070636000 b2 = .2652555E-3 b4 = -.1960834E-4 b6 = .4901447E-10 b7 = .3267598E-7 end lab EoS = 1 | low albite Na2O(.5)Al2O3(.5)SiO2(3) G0 = -3711715 S0 = 207.443 V0 = 10.043 c1 = 393.6357 c3 = -7892826 c5 = -2415.498 c7 = 1070636000 b2 = .2642032E-3 b4 = -.1953055E-4 b6 = .4882003E-10 b7 = .3254635E-7 end alm EoS = 1 | almandine Al2O3(1)SiO2(3)FeO(3) G0 = -4942037 S0 = 341.5824 V0 = 11.524 c1 = 621.4269 c3 = -15081040 c5 = -3287.931 c7 = .2211865E10 b2 = .2143338E-3 b4 = -.6572414E-5 b6 = .5006026E-11 b7 = .8609696E-7 end aop EoS = 1 | aluminoopx Al2O3(1) G0 = -1533560 S0 = 35.375 V0 = 3.093 c1 = 119.38 c3 = -6509130 c5 = 774.808 c7 = 422877600 b2 = .7626044E-4 b4 = -.2317727E-5 b6 = .1381643E-11 b7 = .2309543E-7 end and EoS = 1 | andalusite Al2O3(1)SiO2(1) G0 = -2441806 S0 = 91.4337 V0 = 5.147 c1 = 236.4782 c3 = -7526810 c5 = -1102.941 c7 = 936442400 b2 = .1206593E-3 b4 = -.39634E-5 b6 = .9900255E-11 b7 = .3700178E-8 end ann EoS = 1 | annite Al2O3(.5)SiO2(3)K2O(.5)FeO(3)H2O(1) G0 = -4801071 S0 = 405.01 V0 = 15.487 c1 = 727.208 c3 = -13831900 c5 = -4775.04 c7 = 2119060000 b2 = .5334857E-3 b4 = -.262811E-4 end an EoS = 1 | anorthite Al2O3(1)SiO2(2)CaO(1) G0 = -4003220 S0 = 200.1861 V0 = 10.075 c1 = 439.3694 c5 = -3734.149 c7 = -317023200 b2 = .11E-3 b4 = -.128197E-4 b6 = .3200021E-10 b7 = .4229989E-7 end ap EoS = 1 | anthophyllite MgO(7)SiO2(8)H2O(1) G0 = -11348660 S0 = 537.4 V0 = 26.33 c1 = 1233.792 c3 = -22163800 c5 = -7133.98 c7 = .2333937E10 b2 = .74E-3 b4 = -.3E-4 b7 = .1655999E-6 end cats EoS = 1 | ca-al pyroxene Al2O3(1)SiO2(1)CaO(1) G0 = -3122310 S0 = 140.7508 V0 = 6.356 c1 = 310.6977 c3 = -7455263 c5 = -1671.627 c7 = 948781600 b2 = .141424E-3 b4 = -.553E-5 b6 = .1380015E-10 b7 = .3359972E-7 end cc EoS = 1 | calcite CaO(1)CO2(1) G0 = -1128295 S0 = 91.7248 V0 = 3.69 c1 = 178.1875 c3 = -482722 c5 = -1657.697 c7 = 166604900 b2 = .3286615E-4 b4 = -.51667E-5 b7 = .8391134E-7 end coe EoS = 1 | coesite SiO2(1) G0 = -852584.8 S0 = 39.4244 V0 = 2.064 c1 = 94.90714 c3 = -527867 c5 = -767.338 c7 = 26270730 b2 = .15266E-4 b4 = -.214E-5 b6 = .6192E-11 b7 = .9000072E-8 end cd EoS = 1 | cordierite MgO(2)Al2O3(2)SiO2(5) G0 = -8653709 S0 = 416.2714 V0 = 23.311 c1 = 954.3865 c3 = -2317258 c5 = -7962.274 c7 = -370214100 b2 = .7E-4 b4 = -.27E-4 b7 = .4199943E-7 end fcd EoS = 1 | fe_cordierite Al2O3(2)SiO2(5)FeO(2) G0 = -7945208 S0 = 482.8282 V0 = 23.706 c1 = 983.479 c3 = -1870290 c5 = -8403.659 c7 = -85683500 b2 = .1011E-3 b4 = -.40296E-4 end co EoS = 1 | corundum Al2O3(1) G0 = -1582199 S0 = 50.82 V0 = 2.558 c1 = 155.0189 c3 = -3861363 c5 = -828.387 c7 = 409083600 b2 = .5459156E-4 b4 = -.9853902E-6 b6 = .95925E-12 b7 = .1206864E-7 end acr EoS = 1 | alpha cristobalite SiO2(1) G0 = -853917.7 S0 = 43.3943 V0 = 2.587 c1 = 83.5136 c3 = -2455360 c5 = -374.693 c7 = 280072200 b2 = .5387185E-4 b4 = -.6505029E-5 transition = 1 type = 1 t1 = -.1421619 t2 = .44142E-3 t3 = 535.15 t4 = .48E-1 t7 = 298.15 end bcr EoS = 1 | beta cristobalite SiO2(1) G0 = -853327 S0 = 46.0288 V0 = 2.73 c1 = 83.5136 c3 = -2455360 c5 = -374.693 c7 = 280072200 b2 = .8706538E-5 b4 = -.3002254E-5 b6 = .1511137E-10 end dia EoS = 1 | diaspore Al2O3(.5)H2O(.5) G0 = -920805.9 S0 = 35.3082 V0 = 1.776 c1 = 143.2395 c3 = -323098 c5 = -1540.409 c7 = 64632260 b2 = .5277923E-4 b4 = -.1064342E-5 end di EoS = 1 | diopside MgO(1)SiO2(2)CaO(1) G0 = -3026201 S0 = 142.5 V0 = 6.607 c1 = 305.4133 c3 = -7165973 c5 = -1604.931 c7 = 921837600 b2 = .1836429E-3 b4 = -.5764458E-5 b6 = .1127749E-10 b7 = .5489228E-7 end east EoS = 1 | eastonite MgO(2)Al2O3(1.5)SiO2(2)K2O(.5)H2O(1) G0 = -5942747 S0 = 312.6221 V0 = 14.732 c1 = 619.7933 c3 = -22291180 c5 = -2272.344 c7 = .3004745E10 b2 = .507478E-3 b4 = -.2499989E-4 end fa EoS = 1 | fayalite SiO2(1)FeO(2) G0 = -1378198 S0 = 151.8706 V0 = 4.639 c1 = 251.9962 c5 = -2013.697 c7 = -62189100 b2 = .1215869E-3 b4 = -.3812397E-5 b6 = .9017288E-11 b7 = .3907569E-7 end afe EoS = 1 | fe-a FeO(1)O2(-.5) G0 = -65.593 S0 = 27.5 V0 = .709 c1 = 51.865 c3 = -2543000 c5 = -379.35 c7 = 506800000 b2 = .31955E-4 b4 = -.427E-6 b7 = .9999736E-9 transition = 1 type = 1 t1 = -.22208 t2 = .34823E-3 t3 = 1042 t4 = -.57E-3 t7 = 298.15 t8 = 1000 end gfe EoS = 1 | fe-g FeO(1)O2(-.5) G0 = 5214.148 S0 = 35.6954 V0 = .691 c1 = 66.238 c3 = 6373289 c5 = -1237.113 c7 = -1060400000 b2 = .3258285E-4 b4 = -.3225332E-6 b6 = -.9985641E-12 b7 = .9985641E-9 end fs EoS = 1 | ferrosilite SiO2(1)FeO(1) G0 = -1116159 S0 = 96.5587 V0 = 3.295 c1 = 174.2024 c3 = -454390 c5 = -1392.959 c7 = -37711400 b2 = .1034841E-3 b4 = -.3002089E-5 b6 = .999703E-12 b7 = .264918E-7 end fo EoS = 1 | forsterite MgO(2)SiO2(1) G0 = -2055074 S0 = 94.18 V0 = 4.36 c1 = 233.1803 c5 = -1801.58 c7 = -267937600 b2 = .1284616E-3 b4 = -.3450214E-5 b6 = .5891668E-11 b7 = .3864399E-7 end ge EoS = 1 | gehlenite Al2O3(1)SiO2(1)CaO(2) G0 = -3785954 S0 = 198.6 V0 = 9.033 c1 = 373.0874 c3 = -4778466 c5 = -2276.755 c7 = 477911800 b2 = .2251574E-3 b4 = -.9001298E-5 b6 = .224723E-10 b7 = .5116291E-8 d1 = -221.74 d3 = 17291280 d6 = .3695 d7 = -.15E-3 d8 = 698.15 d9 = 1600 end gk EoS = 1 | geikelite MgO(1)TiO2(1) G0 = -1482611 S0 = 74.17 V0 = 3.077 c1 = 146.2 c3 = -3999800 c5 = -416 c7 = 402330000 b2 = .7173584E-4 b4 = -.1628771E-5 b7 = .2717853E-7 end gr EoS = 1 | grossular Al2O3(1)SiO2(3)CaO(3) G0 = -6270975 S0 = 255.15 V0 = 12.538 c1 = 573.4304 c3 = -18887170 c5 = -2039.405 c7 = .2319312E10 b2 = .2381493E-3 b4 = -.8198769E-5 b6 = .2049963E-10 b7 = .9999807E-7 end hed EoS = 1 | hedenbergite SiO2(2)CaO(1)FeO(1) G0 = -2675203 S0 = 176.5 V0 = 6.791 c1 = 313.3925 c3 = -6171210 c5 = -1762.77 c7 = 809538300 b2 = .1821367E-3 b4 = -.6059431E-5 b6 = .1599077E-10 b7 = .1099327E-7 end hm EoS = 1 | hematite FeO(2)O2(.5) G0 = -744889.5 S0 = 87.36 V0 = 3.027 c1 = 146.8584 c3 = -5576782 c7 = 525627900 b2 = .1159629E-3 b4 = -.1449751E-5 b6 = .920208E-12 b7 = .499455E-9 transition = 1 type = 1 t1 = -.7403236E-1 t2 = .27921E-3 t3 = 955.65 t7 = 298.15 t8 = 1287.92 end hc EoS = 1 | hercynite Al2O3(1)FeO(1) G0 = -1834878 S0 = 122.8623 V0 = 4.07 c1 = 251.7674 c3 = -1348330 c5 = -2044.441 c7 = 131500400 b2 = .6438277E-4 b4 = -.20757E-5 b7 = .3918433E-7 end ilm EoS = 1 | ilmenite TiO2(1)FeO(1) G0 = -1156810 S0 = 108.5 V0 = 3.17 c1 = 149.9995 c3 = -3323694 c5 = -441.622 c7 = 348151000 b2 = .73904E-4 b4 = -.1678E-5 b7 = .2799998E-7 end jd EoS = 1 | jadeite Na2O(.5)Al2O3(.5)SiO2(2) G0 = -2846483 S0 = 133.5739 V0 = 6.034 c1 = 311.293 c3 = -5350264 c5 = -2005.101 c7 = 662566900 b2 = .1394966E-3 b4 = -.5188043E-5 b6 = .1296586E-10 b7 = .1555867E-7 end kao EoS = 1 | kaolinite Al2O3(1)SiO2(2)H2O(2) G0 = -3799770 S0 = 203.7 V0 = 9.952 c1 = 523.2329 c3 = -2244259 c5 = -4426.668 c7 = 92308770 b2 = .318464E-3 b4 = -.119424E-4 end ky EoS = 1 | kyanite Al2O3(1)SiO2(1) G0 = -2443371 S0 = 82.43 V0 = 4.412 c1 = 262.6848 c3 = -1999740 c5 = -2001.407 c7 = -63181880 b2 = .1057668E-3 b4 = -.285E-5 end lw EoS = 1 | lawsonite Al2O3(1)SiO2(2)CaO(1)H2O(2) G0 = -4509709 S0 = 229.1759 V0 = 10.144 c1 = 728.6731 c5 = -8248.055 c7 = 850556400 b2 = .2666185E-3 b4 = -.77988E-5 b6 = .1949981E-10 end lm EoS = 1 | lime CaO(1) G0 = -603350.4 S0 = 37.75 V0 = 1.676 c1 = 58.79117 c3 = -1147146 c5 = -133.904 c7 = 102978800 b2 = .5800696E-4 b4 = -.1712391E-5 b6 = .429894E-11 b7 = .1129725E-7 end mt EoS = 1 | magnetite FeO(3)O2(.5) G0 = -1013773 S0 = 146.25 V0 = 4.452 c1 = 207.9308 c3 = -7243337 c7 = 664356400 b2 = .1348557E-3 b4 = -.2589742E-5 b6 = .7795452E-11 b7 = .6164684E-7 transition = 1 type = 1 t1 = -.1950245 t2 = .61037E-3 t3 = 848.15 t7 = 298.15 t8 = 1565.57 end ma EoS = 1 | margarite Al2O3(2)SiO2(2)CaO(1)H2O(1) G0 = -5852244 S0 = 265.0841 V0 = 12.958 c1 = 699.7957 c3 = -6807750 c5 = -5587.105 c7 = 734321700 b2 = .272358E-3 b4 = -.149652E-4 b6 = .3739938E-10 b7 = .1613997E-6 end me EoS = 1 | meionite Al2O3(3)SiO2(6)CaO(4)CO2(1) G0 = -13105910 S0 = 730 V0 = 34.036 c1 = 1511.345 c5 = -13243.33 c7 = -751614000 b2 = .3178962E-3 b4 = -.377892E-4 end mu EoS = 1 | muscovite Al2O3(1.5)SiO2(3)K2O(.5)H2O(1) G0 = -5596723 S0 = 293.157 V0 = 14.087 c1 = 651.4893 c3 = -18523200 c5 = -3873.229 c7 = .2742469E10 b2 = .4722995E-3 b4 = -.24186E-4 b6 = .6049944E-10 end en EoS = 1 | orthoenstatite MgO(1)SiO2(1) G0 = -1458669 S0 = 66.18 V0 = 3.133 c1 = 166.5795 c3 = -2270560 c5 = -1200.588 c7 = 279150300 b2 = .7724668E-4 b4 = -.23477E-5 b6 = .1399511E-11 b7 = .2339411E-7 end pa EoS = 1 | paragonite Na2O(.5)Al2O3(1.5)SiO2(3)H2O(1) G0 = -5563572 S0 = 277.6991 V0 = 13.216 c1 = 577.5693 c3 = -32214370 c5 = -1472.801 c7 = .5050077E10 b2 = .5210288E-3 b4 = -.2607825E-4 b6 = .6520114E-10 b7 = .7890084E-7 end per EoS = 1 | periclase MgO(1) G0 = -569209.3 S0 = 26.9514 V0 = 1.125 c1 = 61.10965 c3 = -621154 c5 = -296.199 c7 = 5844612 b2 = .421621E-4 b4 = -.7001245E-6 b6 = .1700325E-11 b7 = .40005E-9 end phl EoS = 1 | phlogopite MgO(3)Al2O3(.5)SiO2(3)K2O(.5)H2O(1) G0 = -5834104 S0 = 325.9239 V0 = 14.971 c1 = 610.3799 c3 = -21533010 c5 = -2083.781 c7 = .2841041E10 b2 = .5157109E-3 b4 = -.2540546E-4 end kf EoS = 1 | potassium feldspar Al2O3(.5)SiO2(3)K2O(.5) G0 = -3745415 S0 = 214.1451 V0 = 10.869 c1 = 381.3723 c3 = -12037250 c5 = -1941.045 c7 = 1836425000 b2 = .1646118E-3 b4 = -.1961323E-4 b6 = .5556233E-10 b7 = .5961647E-7 d1 = 282.9829 d2 = -4831.375 d3 = 3620706 d6 = -.15733 d7 = .3E-4 d8 = 298.15 d9 = 1436.15 end sa EoS = 1 | sanidine Al2O3(.5)SiO2(3)K2O(.5) G0 = -3738804 S0 = 229.1571 V0 = 10.896 c1 = 381.3723 c3 = -12037250 c5 = -1941.045 c7 = 1836425000 b2 = .1650207E-3 b4 = -.1966195E-4 b6 = .5570035E-10 b7 = .5976456E-7 end mcr EoS = 1 | microcline Al2O3(.5)SiO2(3)K2O(.5) G0 = -3745415 S0 = 214.1451 V0 = 10.869 c1 = 381.3723 c3 = -12037250 c5 = -1941.045 c7 = 1836425000 b2 = .1646118E-3 b4 = -.1961323E-4 b6 = .5556233E-10 b7 = .5961647E-7 end pr EoS = 1 | prehnite Al2O3(1)SiO2(3)CaO(2)H2O(1) G0 = -5820154 S0 = 288.6335 V0 = 14.016 c1 = 716.0518 c3 = -2182456 c5 = -6404.609 c7 = 268502800 b2 = .205812E-4 b4 = -.2E-4 b7 = .15815E-5 end py EoS = 1 | pyrope MgO(3)Al2O3(1)SiO2(3) G0 = -5934923 S0 = 268.8 V0 = 11.311 c1 = 590.9042 c3 = -13320810 c5 = -2826.956 c7 = 1260328000 b2 = .2547085E-3 b4 = -.65175E-5 b6 = .4999462E-11 b7 = .4190047E-7 end pyph EoS = 1 | pyrophyllite Al2O3(1)SiO2(4)H2O(1) G0 = -5266865 S0 = 239.4 V0 = 12.76 c1 = 665.9307 c3 = -4979913 c5 = -5897.422 c7 = 661808900 b2 = .1612535E-3 b4 = -.172833E-4 b7 = .4869994E-6 end q EoS = 1 | a-quartz SiO2(1) G0 = -856287.6 S0 = 41.46 V0 = 2.269 c1 = 80.01199 c3 = -3546684 c5 = -240.276 c7 = 491568400 b2 = .5421678E-4 b4 = -.5522587E-5 b6 = .2300199E-10 transition = 1 type = 1 t1 = -.9186959E-1 t2 = .24607E-3 t3 = 848 t4 = .23743E-1 t7 = 373 end bq EoS = 1 | b-quartz SiO2(1) G0 = -855033.4 S0 = 44.2068 V0 = 2.37 c1 = 80.01199 c3 = -3546684 c5 = -240.276 c7 = 491568400 b4 = -.2934693E-5 b6 = .1679643E-10 end rt EoS = 1 | rutile TiO2(1) G0 = -889634 S0 = 50.92 V0 = 1.881 c1 = 77.83762 c3 = -3367841 c7 = 402940700 b2 = .4837108E-4 b4 = -.8544458E-6 b6 = .1099444E-11 b7 = .2898433E-8 end sdph EoS = 1 | siderophyllite Al2O3(1.5)SiO2(2)K2O(.5)FeO(2)H2O(1) G0 = -5251334 S0 = 385 V0 = 15.063 c1 = 717.7811 c3 = -15994650 c5 = -4540.026 c7 = .238988E10 b2 = .5188801E-3 b4 = -.2556159E-4 end sil EoS = 1 | sillimanite Al2O3(1)SiO2(1) G0 = -2439266 S0 = 95.93 V0 = 4.983 c1 = 256.7316 c3 = -2977353 c5 = -1887.225 c7 = 250959100 b2 = .669252E-4 b4 = -.375E-5 end sp EoS = 1 | spinel MgO(1)Al2O3(1) G0 = -2177145 S0 = 80.37 V0 = 3.978 c1 = 244.672 c5 = -2003.98 b2 = .862883E-4 b4 = -.19469E-5 b7 = .2010004E-7 end ttn EoS = 1 | titanite SiO2(1)CaO(1)TiO2(1) G0 = -2455134 S0 = 129.29 V0 = 5.565 c1 = 234.6202 c3 = -5118324 c5 = -1040.294 c7 = 591460600 b2 = .140238E-3 b4 = -.328335E-5 end tc EoS = 1 | talc MgO(3)SiO2(4)H2O(1) G0 = -5519218 S0 = 261.21 V0 = 13.61 c1 = 664.1052 c3 = -2147218 c5 = -5187.172 c7 = -327371800 b2 = .4007711E-3 b4 = -.23122E-4 b6 = .7710065E-10 end ltr EoS = 1 | low tridymite SiO2(1) G0 = -854026 S0 = 43.7702 V0 = 2.675 c1 = 75.37267 c3 = -5958095 c7 = 958246100 b2 = .5173316E-4 b4 = -.6710034E-5 transition = 1 type = 1 t1 = .4267049 t2 = -.144575E-2 t3 = 390.15 t7 = 298.15 t8 = 130.54 end wo EoS = 1 | wollastonite SiO2(1)CaO(1) G0 = -1546123 S0 = 81.81 V0 = 3.983 c1 = 149.0727 c3 = -3659348 c5 = -690.295 c7 = 484349400 b2 = .112241E-3 b4 = -.49585E-5 b6 = .1239988E-10 end zo EoS = 1 | zoisite Al2O3(1.5)SiO2(3)CaO(2)H2O(.5) G0 = -6494148 S0 = 297.5759 V0 = 13.588 c1 = 749.1704 c3 = -2380525 c5 = -6509.281 c7 = 124858400 b2 = .47109E-3 b4 = -.7E-5 b6 = .1749999E-10 end CO2 EoS = 102 | carbon dioxide CO2(1) G0 = -394341 S0 = 213.677 c1 = 81.6197 c2 = -.1761E-2 c3 = 972938 c5 = -710.477 c6 = -4103.83 end H2O(L) EoS = 1 | liquid H2O(1) G0 = -237130.3 S0 = 69.915 c1 = 135.3693 c2 = -.452E-3 c3 = -4076072 c5 = -4816.884 c6 = 66876.15 end H2O EoS = 101 | ideal gas water H2O(1) G0 = -228537.9 S0 = 188.72 c1 = 115.45 c2 = -.2062E-2 c3 = -2871300 c5 = -3799.9 c6 = 51055.16 end O2 EoS = 1 | oxygen gas O2(1) S0 = 205.152 c1 = 23.10248 c2 = .3E-2 c3 = 1762835 c5 = 804.888 c6 = -18172.92 end m EoS = 1 | magnesite from trommsdorff and connolly CMP '89 MgO(1)CO2(1) G0 = -1027436 S0 = 65.09 V0 = 2.803 c1 = 162.2966 c3 = -4882646 c5 = -1109.267 c7 = 874661900 b2 = .5167656E-4 b4 = -.2494911E-5 b6 = .6199675E-11 b7 = .1165958E-6 end da EoS = 1 | fe_clinochlore Al2O3(1)SiO2(3)FeO(5)H2O(4) G0 = -6567980 S0 = 573.1545 V0 = 21.747 c1 = 1229.23 c3 = -12277000 c5 = -10256.5 c7 = 2121510000 b2 = .695904E-3 b4 = -.1339587E-3 end czo EoS = 1 | clinozoisite Al2O3(1.5)SiO2(3)CaO(2)H2O(.5) G0 = -6496497 S0 = 287.0759 V0 = 13.673 c1 = 749.1704 c3 = -2380525 c5 = -6509.283 c7 = 124858400 b2 = .4740369E-3 b4 = -.7043788E-5 b6 = .1760946E-10 end pwo EoS = 1 | pseudowollastonite SiO2(1)CaO(1) G0 = -1543085 S0 = 85.2788 V0 = 4.016 c1 = 141.1561 c3 = -5857595 c5 = -417.232 c7 = 940735000 b2 = .1131709E-3 b4 = -.4999582E-5 b6 = .1250261E-10 end htr EoS = 1 | high tridymite SiO2(1) G0 = -853844.3 S0 = 45.5237 V0 = 2.737 c1 = 75.37267 c3 = -5958095 c7 = 958246100 b2 = .1321602E-4 b4 = -.2024513E-5 b6 = .1022379E-10 end fparg EoS = 1 | fepargasite Na2O(.5)Al2O3(1.5)SiO2(6)CaO(2)FeO(4)H2O(1) G0 = -10587020 S0 = 738 V0 = 27.86 c1 = 1351.623 c3 = -29598880 c5 = -8208.323 c7 = .4317209E10 b2 = .8600661E-3 b4 = -.3071676E-4 end parg EoS = 1 | pargasite Na2O(.5)MgO(4)Al2O3(1.5)SiO2(6)CaO(2)H2O(1) G0 = -11991300 S0 = 589.2005 V0 = 27.09 c1 = 1276.262 c3 = -35217190 c5 = -6514.016 c7 = .4745671E10 b2 = .8362954E-3 b4 = -.2986781E-4 end fts EoS = 1 | amphibole fetschermakite Al2O3(2)SiO2(6)CaO(2)FeO(3)H2O(1) G0 = -10790800 S0 = 634.6937 V0 = 27.19 c1 = 1304.708 c3 = -29392510 c5 = -8049.757 c7 = .421487E10 b2 = .662726E-3 b4 = -.378423E-4 b6 = .9464567E-10 b7 = .267381E-6 end ts EoS = 1 | amphibole tschermakite MgO(3)Al2O3(2)SiO2(6)CaO(2)H2O(1) G0 = -11834650 S0 = 517.7058 V0 = 26.921 c1 = 1248.187 c3 = -33606240 c5 = -6779.026 c7 = .4536217E10 b2 = .6561694E-3 b4 = -.3746791E-4 b6 = .9370931E-10 b7 = .2647357E-6 end ftr EoS = 1 | fetremolite SiO2(8)CaO(2)FeO(5)H2O(1) G0 = -9817132 S0 = 725 V0 = 28.37 c1 = 1323.562 c3 = -25067000 c5 = -8519.785 c7 = .3673229E10 b2 = .6914872E-3 b4 = -.3948459E-4 b6 = .9875313E-10 b7 = .2789849E-6 end tr EoS = 1 | tremolite MgO(5)SiO2(8)CaO(2)H2O(1) G0 = -11578550 S0 = 551.1499 V0 = 27.268 c1 = 1229.36 c3 = -32089890 c5 = -6401.9 c7 = .4208808E10 b2 = .6646272E-3 b4 = -.3795086E-4 b6 = .9491718E-10 b7 = .2681481E-6 end fst EoS = 1 | staurolite Al2O3(9)SiO2(7.5)FeO(4)H2O(2) G0 = -22292460 S0 = 1005.327 V0 = 44.676 c1 = 2577.674 c3 = -61185890 c5 = -16265.36 c7 = .8692048E10 b2 = .8013242E-3 b4 = -.357408E-4 b7 = .4038532E-6 end pmp EoS = 1 | pumpellyite MgO(1)Al2O3(2.5)SiO2(6)CaO(4)H2O(3.5) G0 = -13448430 S0 = 584 V0 = 29.55 c1 = 1576 c3 = -28304200 c5 = -10603.8 c7 = .3838351E10 b2 = .1024498E-2 b4 = -.1522298E-4 b6 = .380604E-10 end ne EoS = 1 | nepheline Na2O(.5)Al2O3(.5)SiO2(1) G0 = -1973319 S0 = 124.2 V0 = 5.422 c1 = 205.2419 c3 = -10838270 c5 = -759.898 c7 = 2081817000 b2 = .171076E-3 b4 = -.1203994E-4 b6 = .32532E-10 b7 = .10844E-6 transition = 1 type = 1 t1 = -1.027841 t2 = .339448E-2 t3 = 467.15 t7 = 298.15 t8 = 241.84 end mw EoS = 1 | merwinite MgO(1)SiO2(2)CaO(3) G0 = -4309707 S0 = 251.7767 V0 = 9.847 c1 = 453.6196 c5 = -3250.015 c7 = -344227100 b2 = .2892614E-3 b4 = -.54212E-5 b6 = .1359969E-10 b7 = .859003E-7 end min EoS = 1 | minnesotaite SiO2(4)FeO(3)H2O(1.4) G0 = -4573294 S0 = 378 V0 = 15.34 c1 = 731.094 c3 = -10114240 c5 = -5504.998 c7 = 1598381000 b2 = .4517141E-3 b4 = -.2606109E-4 b6 = .869011E-10 end mo EoS = 1 | monticellite MgO(1)SiO2(1)CaO(1) G0 = -2132222 S0 = 108.3 V0 = 5.148 c1 = 226.3423 c3 = -1179709 c5 = -1542.741 c7 = -23285890 b2 = .1434397E-3 b4 = -.4652014E-5 b6 = .10296E-10 b7 = .3929932E-7 end blc EoS = 1 | bleucite Al2O3(.5)SiO2(2)K2O(.5) G0 = -2852398 S0 = 210.7042 V0 = 9.263 c1 = 271.1397 c3 = -7857238 c5 = -944.133 c7 = 959202600 b2 = .115943E-3 b4 = -.1442087E-4 b6 = .1180014E-10 end gru EoS = 1 | grunerite SiO2(8)FeO(7)H2O(1) G0 = -8964411 S0 = 725 V0 = 27.8 c1 = 1347.83 c3 = -20228480 c5 = -9356.91 c7 = .303919E10 b2 = .78952E-3 b4 = -.417E-4 end gre EoS = 1 | greenalite SiO2(2)FeO(3)H2O(2) G0 = -3006433 S0 = 312.6589 V0 = 11.52 c1 = 619.3301 c2 = -.12107 c3 = -5057120 c5 = -5245.75 c7 = 925344000 b2 = .3127826E-3 b4 = -.2085442E-4 b6 = .5211994E-10 b7 = .7758835E-7 end min EoS = 1 | minnesotaite SiO2(4)FeO(3)H2O(1.4) G0 = -4573294 S0 = 378 V0 = 15.34 c1 = 731.094 c3 = -10114240 c5 = -5504.998 c7 = 1598381000 b2 = .4517141E-3 b4 = -.2606109E-4 b6 = .869011E-10 end alc EoS = 1 | aleucite Al2O3(.5)SiO2(2)K2O(.5) G0 = -2858083 S0 = 199.2 V0 = 8.839 c1 = 271.1397 c3 = -7857238 c5 = -944.133 c7 = 959202600 b2 = .166E-3 b4 = -.1591E-4 b6 = .3980025E-10 b7 = .9260002E-6 transition = 1 type = 1 t1 = -.9730853E-1 t2 = .3373E-3 t3 = 955.15 t7 = 298.15 end glc EoS = 1 | glaucophane Na2O(1)MgO(3)Al2O3(1)SiO2(8)H2O(1) G0 = -11225470 S0 = 535 V0 = 26.05 c1 = 1717.5 c2 = -.12107 c3 = 7075000 c5 = -19272 b2 = .5731E-3 b4 = -.30218E-4 b6 = .75545E-10 b7 = .22924E-6 end pen EoS = 1 | protoenstatite MgO(1)SiO2(1) G0 = -1456965 S0 = 67.4376 V0 = 3.242 c1 = 166.5795 c3 = -2270560 c5 = -1200.588 c7 = 279150300 b2 = .5456837E-4 b4 = -.2430203E-5 b6 = .1452416E-11 b7 = .3781793E-7 end cen EoS = 1 | clinoenstatite MgO(1)SiO2(1) G0 = -1458601 S0 = 66.3251 V0 = 3.131 c1 = 139.9582 c3 = -4400237 c5 = -497.034 c7 = 535708900 b2 = .6861586E-4 b4 = -.2346998E-5 b6 = .1402688E-11 b7 = .2345745E-7 end ep EoS = 1 | epidote Al2O3(1)SiO2(3)CaO(2)FeO(1)O2(.25)H2O(.5) G0 = -6072068 S0 = 314.9715 V0 = 13.92 c1 = 701.6863 c3 = 9724417 c5 = -5528.332 c7 = -.3537578E10 b2 = .4826003E-3 b4 = -.7171033E-5 b6 = .1792757E-10 end do EoS = 1 | dolomite MgO(1)CaO(1)CO2(2) G0 = -2162354 S0 = 154.89 V0 = 6.432 c1 = 328.4827 c3 = -4688477 c5 = -2554.425 c7 = 790382300 b2 = .9152889E-4 b4 = -.6883465E-5 b7 = .233982E-6 d1 = -9.423 d2 = -2.2726 d3 = 385300 d6 = .1732E-1 d7 = .1E-4 d8 = 298.15 d9 = 1423 end chl EoS = 1 | clinochlore MgO(5)Al2O3(1)SiO2(3)H2O(4) G0 = -8250546 S0 = 435.1545 V0 = 21.147 c1 = 1214.284 c5 = -11217.13 c7 = -1256253000 b2 = .5593707E-3 b4 = -.3847635E-4 end chr EoS = 1 | chrysotile MgO(3)SiO2(2)H2O(2) G0 = -4035373 S0 = 220.1345 V0 = 10.72 c1 = 610.022 c3 = -1857300 c5 = -5581.152 c7 = 195472000 b2 = .2910616E-3 b4 = -.194062E-4 b6 = .485005E-10 b7 = .7220027E-7 end ant EoS = 1 | antigorite MgO(48)SiO2(34)H2O(31) G0 = -66076530 S0 = 3602.996 V0 = 174.246 c1 = 7394.512 c3 = -548363000 c7 = .8728412E11 b2 = .435E-2 b4 = -.3446195E-3 b6 = .8615071E-9 b7 = .6872959E-6 end br EoS = 1 | brucite MgO(1)H2O(1) G0 = -834867.9 S0 = 63.0642 V0 = 2.468 c1 = 136.839 c3 = -4361949 c5 = -537.13 c7 = 552694500 b2 = .810833E-4 b4 = -.49924E-5 b6 = .1660001E-10 b7 = .2699992E-8 end andr EoS = 1 | andradite SiO2(3)CaO(3)FeO(2)O2(.5) G0 = -5414788 S0 = 318.1403 V0 = 13.209 c1 = 596.1593 c3 = -13292860 c5 = -2530.37 c7 = 1395897000 b2 = .281794E-3 b4 = -.841334E-5 b6 = .290598E-10 b7 = .6210872E-7 end ak EoS = 1 | akermanite MgO(1)SiO2(2)CaO(2) G0 = -3663786 S0 = 212 V0 = 9.252 c1 = 387.064 c5 = -2938.769 c7 = -40790480 b2 = .2314044E-3 b4 = -.7264121E-5 b7 = .6219564E-7 transition = 1 type = 1 t3 = 358 t7 = 298.15 t8 = 452 end FeC4H6O4 EoS = 16 FeO(1)O2(-4)H2O(3)CO2(4) G0 = -844331.2 S0 = 48.24152 w = -15899.2 a1 = 6.064634 a2 = 3982.069 a3 = -13.14665 a4 = -132735.2 c1 = 476.0099 c2 = 1442934. end FeC2H3O2 EoS = 16 FeO(1)O2(-2.25)H2O(1.5)CO2(2) G0 = -468189.6 S0 = -6.276 w = 240831 q = 1 a1 = 2.799339 a2 = 873.1844 a3 = 12.92104 a4 = -119883.1 c1 = 247.097 c2 = 565082.7 end NaCO3- EoS = 16 Na2O(.5)O2(.25)CO2(1) G0 = -797311.4 S0 = 33.472 w = 630925.4 q = -1 a1 = 3.197719 a2 = 1252.482 a3 = 9.740673 a4 = -121451.1 c1 = 81.47511 c2 = -135490.5 end CO3-2 EoS = 16 O2(.5)CO2(1) G0 = -527983.1 S0 = -54.1828 w = 1924640 q = -2 a1 = 2.42672 a2 = 2092 a3 = -8.368 a4 = -451872 c1 = 75.312 c2 = -836800 end CO2,aq EoS = 16 CO2(1) G0 = -385974 S0 = 117.5704 w = -83680 a1 = 3.259336 a2 = 1313.776 a3 = 9.24664 a4 = -121754.4 c1 = 154.808 c2 = 271960 end BENZENE EoS = 16 O2(-7.5)H2O(3)CO2(6) G0 = 133888 S0 = 149.3688 w = -104600 a1 = 7.330326 a2 = 5187.156 a3 = -23.25091 a4 = -137716.4 c1 = 279.9096 c2 = 410032 end ACETATE EoS = 16 O2(-1.75)H2O(1.5)CO2(2) G0 = -369321.7 S0 = 86.1904 w = 551534.9 q = -1 a1 = 3.243646 a2 = 3639.913 a3 = 31.72518 a4 = -131314.8 c1 = 110.0392 c2 = -161502.4 end ACETIC-A EoS = 16 O2(-1.75)H2O(1.5)CO2(2) G0 = -396475.8 S0 = 178.6568 w = -31798.4 a1 = 4.8116 a2 = 2301.2 a3 = 6.98728 a4 = -120080.8 c1 = 187.8616 c2 = -110039.2 end Al+3 EoS = 16 Al2O3(.5)O2(-.75) G0 = -483708.1 S0 = -325.0968 w = 1151855 q = 3 a1 = -1.414276 a2 = -7115.771 a3 = 60.7454 a4 = -86851.47 c1 = 44.7688 c2 = -337230.4 end AlO2- EoS = 16 Al2O3(.5)O2(.25) G0 = -831331.5 S0 = -30.20848 w = 728769.1 q = -1 a1 = 1.798283 a2 = 1044.996 a3 = -7.639147 a4 = -120595.4 c1 = 79.9144 c2 = -259408 end Ca(HCO3) EoS = 16 CaO(1)O2(-.25)H2O(.5)CO2(1) G0 = -1145705 S0 = 66.944 w = 292880 q = 1 a1 = 3.824176 a2 = 1849.328 a3 = 4.72792 a4 = -123846.4 c1 = 275.7256 c2 = 648520 end Ca(OH)+ EoS = 16 CaO(1)O2(-.25)H2O(.5) G0 = -716719.2 S0 = 28.0328 w = 188112.6 q = 1 a1 = .8807537 a2 = -953.4993 a3 = 28.23762 a4 = -112331.6 c1 = 46.5645 c2 = -115035.7 end Ca+2 EoS = 16 CaO(1)O2(-.5) G0 = -552790.1 S0 = -56.484 w = 517393.4 q = 2 a1 = -.102508 a2 = -3034.237 a3 = 20.92 a4 = -103763.2 c1 = 37.656 c2 = -105436.8 end CaCl+ EoS = 16 CaO(1)Cl2(.5)O2(-.5) G0 = -682410.4 S0 = 18.828 w = 195602 q = 1 a1 = 1.648166 a2 = -222.8465 a3 = 22.11116 a4 = -115352.1 c1 = 86.733 c2 = 22181.48 end CaCl2,aq EoS = 16 CaO(1)Cl2(.5)O2(-.5) G0 = -811696 S0 = 25.104 w = -15899.2 a1 = 3.334383 a2 = 1382.599 a3 = 8.649652 a4 = -121989 c1 = 97.3351 c2 = 126757.4 end CaCO3,aq EoS = 16 CaO(1)CO2(1) G0 = -1099346 w = 836800 a1 = 2.786544 a2 = 857.72 a3 = 13.05408 a4 = -119662.4 c1 = 137.2352 c2 = -7531.2 end CaSO4,aq EoS = 16 CaO(1)O2(1.5)S2(.5) G0 = -1309299 S0 = 20.92 w = -15899.2 a1 = 1.010419 a2 = -830.0448 a3 = 27.20246 a4 = -112842 c1 = -36.96574 c2 = -340037.9 end Cl- EoS = 16 Cl2(.5) G0 = -131289.7 S0 = 56.73504 w = 609190.4 q = -1 a1 = 1.686989 a2 = 2008.738 a3 = 23.27559 a4 = -119118.5 c1 = -18.4096 c2 = -239073.8 end CO,aq EoS = 16 O2(-.5)CO2(1) G0 = -120005.5 S0 = 102.6335 w = -155435.6 a1 = 3.308082 a2 = 1357.558 a3 = 8.859616 a4 = -121885.5 c1 = 169.6403 c2 = 422753.5 end Cr+2 EoS = 16 O2(-.75)Cr2O3(.5) G0 = -164849.6 S0 = -101.2528 w = 597768.1 q = 2 a1 = -.4000531 a2 = -3910.884 a3 = 40.34542 a4 = -100105.8 c1 = 62.97226 c2 = -189184.2 end Cr+3 EoS = 16 O2(-.75)Cr2O3(.5) G0 = -206271.2 S0 = -322.168 w = 1146542 q = 3 a1 = -3.050325 a2 = -1192.543 a3 = 55.82466 a4 = -111343.4 c1 = 75.27723 c2 = -322140.5 end Cr2O7-2 EoS = 16 O2(2)Cr2O3(1) G0 = -1301224 S0 = 261.9184 w = 947843.4 q = -2 a1 = 7.022584 a2 = 4894.133 a3 = -20.79422 a4 = -136505.7 c1 = 63.10248 c2 = -300830.8 end CrO4-2 EoS = 16 O2(1.25)Cr2O3(.5) G0 = -731363.2 S0 = 57.7392 w = 1256204 q = -2 a1 = 4.200423 a2 = -2599.656 a3 = 6.943304 a4 = -105526.4 c1 = -11.96802 c2 = -660498.2 end Cu+ EoS = 16 O2(-.5)CuO(1) G0 = 49998.8 S0 = 40.5848 w = 140205.8 q = 1 a1 = .5421455 a2 = -3012.722 a3 = 32.82242 a4 = -103818.8 c1 = 72.31214 c2 = -10203.06 end Cu+2 EoS = 16 O2(-.5)CuO(1) G0 = 65584.2 S0 = -97.0688 w = 617935 q = 2 a1 = -.6182435 a2 = -3973.073 a3 = 41.92961 a4 = -99848.68 c1 = 77.26877 c2 = -145950.9 end ETHANE,A EoS = 16 O2(-3.5)H2O(3)CO2(2) G0 = -16259.02 S0 = 112.173 w = -169870.4 a1 = 4.71504 a2 = 2697.121 a3 = -2.372493 a4 = -127423.3 c1 = 226.6701 c2 = 625596.7 end ETHANOL, EoS = 16 O2(-2.75)H2O(2.5)CO2(2) G0 = -181292.7 S0 = 150.2056 w = -85228.08 a1 = 3.863213 a2 = 4166.469 a3 = 50.81259 a4 = -133494.7 c1 = 251.1132 c2 = 6305.288 end ETHYLENE EoS = 16 O2(-3)H2O(2)CO2(2) G0 = 81378.8 S0 = 119.6624 w = -129704 a1 = 4.311779 a2 = 2313.166 a3 = .8468416 a4 = -125838 c1 = 184.096 c2 = 539736 end Fe+2 EoS = 16 FeO(1)O2(-.5) G0 = -91504.08 S0 = -105.8552 w = 609776.2 q = 2 a1 = -.3829692 a2 = -3906.015 a3 = 40.22138 a4 = -100125.9 c1 = 62.6067 c2 = -194299.9 end Fe+3 EoS = 16 FeO(1)O2(-.5) G0 = -17238.08 S0 = -277.3992 w = 1079974 q = 3 a1 = -2.647276 a2 = -1488.173 a3 = 53.34302 a4 = -110121.3 c1 = 79.68887 c2 = -285490.9 end FeCl+ EoS = 16 FeO(1)Cl2(.5)O2(-.5) G0 = -221877.5 S0 = -42.09104 w = 293005.5 q = 1 a1 = 1.24797 a2 = -603.8728 a3 = 25.30603 a4 = -113776.9 c1 = 103.2346 c2 = 48346.85 end FeCl+2 EoS = 16 FeO(1)Cl2(.5)O2(-.5) G0 = -157205.4 S0 = -120.0808 w = 624462 q = 2 a1 = -.9170021 a2 = -2665.141 a3 = 42.58957 a4 = -105255.7 c1 = 90.9335 c2 = -100550.2 end FeCl2,aq EoS = 16 FeO(1)Cl2(1)O2(-.5) G0 = -307440.3 S0 = 179.912 w = -15899.2 a1 = 2.936221 a2 = 1003.51 a3 = 11.82828 a4 = -120421.9 c1 = 93.33807 c2 = 112864.8 end FORMATE, EoS = 16 O2(-.25)H2O(.5)CO2(1) G0 = -350878.6 S0 = 90.7928 w = 544045.5 q = -1 a1 = 2.204299 a2 = 3214.818 a3 = 14.52099 a4 = -129561.7 c1 = 71.128 c2 = -518816 end FORMIC-A EoS = 16 O2(-.25)H2O(.5)CO2(1) G0 = -372300.7 S0 = 162.7576 w = -144013.3 a1 = 3.385902 a2 = 1431.639 a3 = 8.238714 a4 = -122193.7 c1 = 92.853 c2 = -130524.1 end GLUTARAT EoS = 16 O2(-6.25)H2O(3.5)CO2(5) G0 = -714878.2 S0 = 221.3336 w = 346393.4 q = -1 a1 = 7.783037 a2 = 5618.159 a3 = -26.86512 a4 = -139498.8 c1 = 107.0221 c2 = 44415.74 end GLUTARIC EoS = 16 O2(-5)H2O(4)CO2(5) G0 = -739647.5 S0 = 306.2688 w = -41840 a1 = 8.667958 a2 = 6460.692 a3 = -33.92968 a4 = -142981.9 c1 = 179.1378 c2 = 419389.1 end GLYCOLAT EoS = 16 O2(-2.25)H2O(1.5)CO2(2) G0 = -506975.3 S0 = 109.6208 w = 516054.6 q = -1 a1 = 2.819269 a2 = 5520.075 a3 = 7.748272 a4 = -139093.4 c1 = 89.28219 c2 = -71571.73 end GLYCOLIC EoS = 16 O2(-1.5)H2O(2)CO2(2) G0 = -528857.6 S0 = 180.3304 w = -126231.3 a1 = 4.780671 a2 = 2759.609 a3 = -2.896444 a4 = -127681.6 c1 = 125.7425 c2 = 260824.1 end H+ EoS = 16 O2(-.25)H2O(.5) q = 1 HOH = 1 end H2,aq EoS = 16 O2(-.5)H2O(1) G0 = 17723.42 S0 = 57.7392 w = -87445.6 a1 = 2.151706 a2 = 1998.195 a3 = 16.20421 a4 = -124532.6 c1 = 115.5834 c2 = 213091.1 end H2S,aq EoS = 16 O2(-.5)H2O(1)S2(.5) G0 = -27919.83 S0 = 125.52 w = -41840 a1 = 3.453581 a2 = 1496.088 a3 = 7.698061 a4 = -122458.2 c1 = 126.9767 c2 = 238090.7 end HAlO2,aq EoS = 16 Al2O3(.5)H2O(.5) G0 = -868180 S0 = -27.196 w = 209200 a1 = 1.792844 a2 = -85.10256 a3 = 20.9564 a4 = -115921.9 c1 = 161.548 c2 = 277867.8 end HCl,aq EoS = 16 Cl2(.5)O2(-.25)H2O(.5) G0 = -127235.4 S0 = 13.3888 w = -83680 a1 = 1.81486 a2 = -64.13763 a3 = 20.7804 a4 = -116008.2 c1 = 113.723 c2 = 205421.8 end HCO3- EoS = 16 O2(.25)H2O(.5)CO2(1) G0 = -586939.9 S0 = 98.44952 w = 532748.7 q = -1 a1 = 3.20076 a2 = 384.928 a3 = 2.5104 a4 = -117988.8 c1 = 46.024 c2 = -158992 end HCrO4- EoS = 16 O2(1)H2O(.5)Cr2O3(.5) G0 = -764835.2 S0 = 184.096 w = 402584.5 q = -1 a1 = 4.404584 a2 = 2401.537 a3 = .1059535 a4 = -126201.3 c1 = 112.9139 c2 = 46900.93 end HEXANE,A EoS = 16 O2(-6.25)H2O(.5)CO2(6) G0 = 18493.28 S0 = 222.5888 w = -196648 a1 = 9.805162 a2 = 7543.417 a3 = -43.00817 a4 = -147456.7 c1 = 451.872 c2 = 962320 end HO2- EoS = 16 O2(.75)H2O(.5) G0 = -67362.4 S0 = 23.8488 w = 646386.2 q = -1 a1 = 1.409339 a2 = -450.2336 a3 = 24.01778 a4 = -114412.1 c1 = 11.2995 c2 = -384353.7 end HS- EoS = 16 O2(-.25)H2O(.5)S2(.5) G0 = 11966.24 S0 = 68.1992 w = 602914.4 q = -1 a1 = 2.603292 a2 = 686.5283 a3 = 14.48614 a4 = -119111.5 c1 = 25.93701 c2 = -319557.1 end HSiO3- EoS = 16 SiO2(1)O2(.25)H2O(.5) G0 = -1015879 S0 = 20.92 w = 648980.2 q = -1 a1 = 1.353709 a2 = -503.1988 a3 = 24.46189 a4 = -114193.1 c1 = 34.09683 c2 = -305946.6 end HSO3- EoS = 16 O2(1.25)H2O(.5)S2(.5) G0 = -527727.9 S0 = 139.7456 w = 469988.7 q = -1 a1 = 2.803866 a2 = 3590.541 a3 = 9.945786 a4 = -131118.2 c1 = 65.66746 c2 = -138900.4 end HSO4- EoS = 16 O2(1.75)H2O(.5)S2(.5) G0 = -755755.9 S0 = 125.52 w = 491536.3 q = -1 a1 = 3.73216 a2 = 1761.323 a3 = 5.474089 a4 = -123554.7 c1 = 84.08181 c2 = -81795.85 end HSO5- EoS = 16 O2(2.25)H2O(.5)S2(.5) G0 = -637516.1 S0 = 212.1288 w = 360284.2 q = -1 a1 = 4.928688 a2 = 2900.536 a3 = -4.078103 a4 = -128264.2 c1 = 130.5936 c2 = 121896.1 end K+ EoS = 16 K2O(.5)O2(-.25) G0 = -282461.8 S0 = 101.0436 w = 80625.68 q = 1 a1 = 1.489086 a2 = -616.3032 a3 = 22.74004 a4 = -113470.1 c1 = 30.9616 c2 = -74935.44 end KCl,aq EoS = 16 K2O(.5)Cl2(.5)O2(-.25) G0 = -413379.2 S0 = 184.096 w = 167360 a1 = 3.479164 a2 = 1520.445 a3 = 7.493825 a4 = -122558.9 c1 = -.4657178 c2 = -271855.4 end KOH,aq EoS = 16 K2O(.5)H2O(.5) G0 = -430115.2 S0 = 151.8792 w = 200832 a1 = 2.381992 a2 = 475.8284 a3 = 16.25284 a4 = -118240.4 c1 = 28.36486 c2 = -182365.9 end KSO4- EoS = 16 K2O(.5)O2(1.75)S2(.5) G0 = -1031649 S0 = 142.256 w = 460072.6 q = -1 a1 = 4.976565 a2 = 2946.119 a3 = -4.460317 a4 = -128452.6 c1 = 14.24101 c2 = -314469.4 end LACTATE, EoS = 16 O2(-3.75)H2O(2.5)CO2(3) G0 = -512665.5 S0 = 133.4696 w = 479863 q = -1 a1 = 3.555424 a2 = 8278.58 a3 = -.3577639 a4 = -150497 c1 = 135.4797 c2 = 100587.9 end LACTIC-A EoS = 16 O2(-3)H2O(3)CO2(3) G0 = -534715.2 S0 = 208.3632 w = -107612.5 a1 = 6.222155 a2 = 4132.045 a3 = -14.40419 a4 = -133355.2 c1 = 179.4401 c2 = 441501.3 end METHANE, EoS = 16 O2(-2)H2O(2)CO2(1) G0 = -34451.06 S0 = 87.82216 w = -167360 a1 = 3.481088 a2 = 1522.976 a3 = 7.48936 a4 = -122591.2 c1 = 171.1256 c2 = 269868 end METHANOL EoS = 16 O2(-1.25)H2O(1.5)CO2(1) G0 = -175937.2 S0 = 132.2144 w = -62760 a1 = 3.51456 a2 = 1715.44 a3 = -1.00416 a4 = -59831.2 c1 = 143.9296 c2 = 40166.4 end Mg(HCO3) EoS = 16 MgO(1)O2(-.25)H2O(.5)CO2(1) G0 = -1046837 S0 = -12.552 w = 250412.4 q = 1 a1 = 2.860815 a2 = 931.7156 a3 = 12.43027 a4 = -120125.1 c1 = 197.8344 c2 = 390790.5 end Mg(HSiO3 EoS = 16 MgO(1)SiO2(1)O2(-.25)H2O(.5) G0 = -1477057 S0 = -99.49552 w = 381507.3 q = 1 a1 = 1.022271 a2 = -818.761 a3 = 27.10785 a4 = -112888.6 c1 = 153.6864 c2 = 195364.9 end Mg+2 EoS = 16 MgO(1)O2(-.5) G0 = -453984.9 S0 = -138.072 w = 643164.5 q = 2 a1 = -.3437993 a2 = -3597.822 a3 = 35.10376 a4 = -99997.6 c1 = 87.0272 c2 = -246521.3 end MgCl+ EoS = 16 MgO(1)Cl2(.5)O2(-.5) G0 = -584504.8 S0 = -79.496 w = 353506.2 q = 1 a1 = 1.343064 a2 = -2058.528 a3 = 26.23368 a4 = -107947.2 c1 = 119.6624 c2 = 86106.72 end MgCO3,aq EoS = 16 MgO(1)CO2(1) G0 = -998971.8 S0 = -100.416 w = -15899.2 a1 = 2.083018 a2 = 191.1754 a3 = 18.63963 a4 = -117063.7 c1 = -36.47532 c2 = -338333.3 end MgOH+ EoS = 16 MgO(1)O2(-.25)H2O(.5) G0 = -624357.4 S0 = -79.9144 w = 353506.2 q = 1 a1 = .5375467 a2 = -1280.266 a3 = 30.97753 a4 = -110980.7 c1 = 133.8923 c2 = 135531.9 end MgSO4,aq EoS = 16 MgO(1)O2(1.5)S2(.5) G0 = -1211055 S0 = -4.184 w = 20920 a1 = 3.490181 a2 = 1530.934 a3 = 7.405874 a4 = -122602.2 c1 = 76.77004 c2 = 43488.5 end Mn+2 EoS = 16 MnO(1)O2(-.5) G0 = -228028 S0 = -73.6384 w = 586011 q = 2 a1 = -.4722822 a2 = -2241.724 a3 = 39.03925 a4 = -107006.1 c1 = 69.73599 c2 = -161910.4 end MnCl+ EoS = 16 MnO(1)Cl2(.5)O2(-.5) G0 = -361037.4 S0 = 50.208 w = 154222.2 q = 1 a1 = 1.222031 a2 = -628.5696 a3 = 25.51311 a4 = -113674.9 c1 = 100.4031 c2 = 82945.55 end MnO4- EoS = 16 MnO(1)O2(1.5) G0 = -447269.6 S0 = 191.2088 w = 391957.1 q = -1 a1 = 2.883736 a2 = 5761.644 a3 = 7.038408 a4 = -140092 c1 = 57.49853 c2 = -142305.8 end MnO4-2 EoS = 16 MnO(1)O2(1.5) G0 = -500824.8 S0 = 58.576 w = 1256204 q = -2 a1 = 4.960708 a2 = -2382.96 a3 = 1.423189 a4 = -106422.2 c1 = -3.876457 c2 = -632374 end MnSO4,aq EoS = 16 MnO(1)O2(1.5)S2(.5) G0 = -985917.8 S0 = 20.92 w = -15899.2 a1 = 3.001227 a2 = 1065.402 a3 = 11.30932 a4 = -120677.7 c1 = -28.33382 c2 = -310035.5 end Na+ EoS = 16 Na2O(.5)O2(-.25) G0 = -261880.7 S0 = 58.40864 w = 138323 q = 1 a1 = .7694376 a2 = -956.044 a3 = 13.6231 a4 = -114055.8 c1 = 76.06512 c2 = -124725 end NaCl,aq EoS = 16 Na2O(.5)Cl2(.5)O2(-.25) G0 = -388735.4 S0 = 117.152 w = -15899.2 a1 = 2.578694 a2 = 663.108 a3 = 14.68252 a4 = -119014.6 c1 = 45.1995 c2 = -54452.54 end NaHCO3,a EoS = 16 Na2O(.5)H2O(.5)CO2(1) G0 = -849720.2 S0 = 154.808 w = -15899.2 a1 = 3.976317 a2 = 1993.784 a3 = 3.524925 a4 = -124515.7 c1 = 110.1592 c2 = 171330.6 end NaHSiO3, EoS = 16 Na2O(.5)SiO2(1)H2O(.5) G0 = -1285074 S0 = 79.496 w = -15899.2 a1 = 2.148024 a2 = 253.0675 a3 = 18.12067 a4 = -117319.5 c1 = 30.07439 c2 = -107023.5 end NaOH,aq EoS = 16 Na2O(.5)H2O(.5) G0 = -422165.6 S0 = 27.196 w = 83680 a1 = 1.651383 a2 = -219.7855 a3 = 22.08566 a4 = -115365.4 c1 = 136.498 c2 = 230990.3 end Ni+2 EoS = 16 NiO(1)O2(-.5) G0 = -45605.6 S0 = -128.8672 w = 630403.3 q = 2 a1 = -1.051064 a2 = -4096.435 a3 = 45.07214 a4 = -99338.7 c1 = 55.18928 c2 = -226686.1 end O2,aq EoS = 16 O2(1) G0 = 16543.54 S0 = 108.9514 w = -164975.1 a1 = 2.422076 a2 = 2658.346 a3 = 13.60972 a4 = -127264.7 c1 = 147.917 c2 = 350309.6 end OH- EoS = 16 O2(.25)H2O(.5) G0 = -157297.5 S0 = -20.92 w = 719648 q = -1 a1 = .87864 a2 = -2092 a3 = 4.184 a4 = -112968 c1 = 50.71008 c2 = -314636.8 HOH = 2 end PROPANE, EoS = 16 O2(-5)H2O(4)CO2(3) G0 = -8213.192 S0 = 139.6201 w = -211417.5 a1 = 5.978973 a2 = 3900.511 a3 = -12.4628 a4 = -132398.1 c1 = 277.5228 c2 = 815651.3 end PROPANOA EoS = 16 O2(-3.25)H2O(2.5)CO2(3) G0 = -363045.7 S0 = 110.876 w = 513627.8 q = -1 a1 = 3.505606 a2 = 8090.392 a3 = .192464 a4 = -149720.3 c1 = 218.8232 c2 = -175728 end PROPANOI EoS = 16 O2(-3.5)H2O(3)CO2(3) G0 = -390994.8 S0 = 206.6896 w = -37656 a1 = 6.10864 a2 = 3305.36 a3 = 28.8696 a4 = -179912 c1 = 264.8472 c2 = -58576 end PROPANOL EoS = 16 O2(-4.25)H2O(3.5)CO2(3) G0 = -175351.4 S0 = 169.8704 w = -83680 a1 = 6.10864 a2 = 3807.44 a3 = 51.0448 a4 = -230120 c1 = 310.8712 c2 = 138072 end S2-2 EoS = 16 S2(1) G0 = 79496 S0 = 28.4512 w = 1300513 q = -2 a1 = 4.266631 a2 = -2580.786 a3 = 6.462593 a4 = -105604.4 c1 = -14.01514 c2 = -681801.7 end S2O3-2 EoS = 16 O2(1.5)S2(1) G0 = -522581.6 S0 = 66.944 w = 1242397 q = -2 a1 = 5.062637 a2 = -2353.908 a3 = .6831273 a4 = -106542.3 c1 = -.2421202 c2 = -615320.7 end S2O4-2 EoS = 16 O2(2)S2(1) G0 = -600404 S0 = 92.048 w = 1203820 q = -2 a1 = 5.730095 a2 = -2163.669 a3 = -4.163005 a4 = -107328.8 c1 = 6.991073 c2 = -577827.2 end S2O5-2 EoS = 16 O2(2.5)S2(1) G0 = -790776 S0 = 104.6 w = 1185871 q = -2 a1 = 6.019607 a2 = -2081.152 a3 = -6.265026 a4 = -107669.9 c1 = 11.22296 c2 = -557370.6 end S2O6-2 EoS = 16 O2(3)S2(1) G0 = -966504 S0 = 125.52 w = 1154240 q = -2 a1 = 6.491129 a2 = -1946.759 a3 = -9.688554 a4 = -108225.5 c1 = 18.11754 c2 = -523278.1 end S2O8-2 EoS = 16 O2(4)S2(1) G0 = -1115036 S0 = 244.3456 w = 974077 q = -2 a1 = 9.956172 a2 = -959.1524 a3 = -34.84677 a4 = -112308.2 c1 = 54.23849 c2 = -340040.1 end S3-2 EoS = 16 S2(1.5) G0 = 73638.4 S0 = 66.1072 w = 1244698 q = -2 a1 = 5.133981 a2 = -2333.573 a3 = .1651262 a4 = -106626.4 c1 = -1.503308 c2 = -620441.1 end S3O6-2 EoS = 16 O2(3)S2(1.5) G0 = -958136 S0 = 138.072 w = 1135161 q = -2 a1 = 6.790004 a2 = -1861.574 a3 = -11.85856 a4 = -108577.6 c1 = 22.24529 c2 = -502821.7 end S4-2 EoS = 16 S2(2) G0 = 69036 S0 = 103.3448 w = 1187838 q = -2 a1 = 5.990776 a2 = -2089.37 a3 = -6.055695 a4 = -107635.9 c1 = 10.91296 c2 = -559077.8 end S4O6-2 EoS = 16 O2(3)S2(2) G0 = -1040561 S0 = 257.316 w = 954161.2 q = -2 a1 = 9.534209 a2 = -1079.42 a3 = -31.78307 a4 = -111811 c1 = 61.47692 c2 = -308503.8 end S5-2 EoS = 16 S2(2.5) G0 = 65688.8 S0 = 140.5824 w = 1131814 q = -2 a1 = 6.848042 a2 = -1845.032 a3 = -12.27994 a4 = -108646 c1 = 23.16289 c2 = -498560.5 end S5O6-2 EoS = 16 O2(3)S2(2.5) G0 = -958136 S0 = 167.36 w = 1091020 q = -2 a1 = 7.464201 a2 = -1669.414 a3 = -16.75362 a4 = -109372 c1 = 31.90998 c2 = -455095.1 end Si2O4,aq EoS = 16 SiO2(2) G0 = -1676742 S0 = 75.312 w = 41840 a1 = 4.214292 a2 = 1126.793 a3 = 2.809556 a4 = -120930.2 c1 = 149.8077 c2 = 290649.9 end SiO2,aq EoS = 16 SiO2(1) G0 = -834946.5 S0 = 22.1752 w = 150624 a1 = 2.050076 a2 = 589.5256 a3 = 18.43721 a4 = -118708.4 c1 = 107.6003 c2 = 109114.5 end SO2,aq EoS = 16 O2(1)S2(.5) G0 = -301164.3 S0 = 161.9208 w = -102968.2 a1 = 3.715161 a2 = 1745.137 a3 = 5.609803 a4 = -123487.8 c1 = 130.5824 c2 = 270197.4 end SO3-2 EoS = 16 O2(1.5)S2(.5) G0 = -486599.2 S0 = -29.288 w = 1389506 q = -2 a1 = 2.858596 a2 = -2982.104 a3 = 16.68574 a4 = -103945.3 c1 = -32.78943 c2 = -775553.4 end SO4-2 EoS = 16 O2(2)S2(.5) G0 = -744459.1 S0 = 18.828 w = 1316412 q = -2 a1 = 3.473306 a2 = -830.3566 a3 = -25.99184 a4 = -112842.5 c1 = 6.86176 c2 = -753036.3 end TOLUENE, EoS = 16 O2(-9)H2O(4)CO2(7) G0 = 126607.8 S0 = 184.096 w = -121336 a1 = 8.500549 a2 = 6301.271 a3 = -32.59294 a4 = -142322.9 c1 = 341.8328 c2 = 598312 end mfer EoS = 1 | magnesioferite from Ghiorso MgO(1)FeO(2)O2(.5) G0 = -1294726 S0 = 122.765 V0 = 4.457 c1 = 196.66 c3 = -7492200 c7 = 810070000 b2 = .1350071E-3 b4 = -.259265E-5 b6 = .7804207E-11 b7 = .6171608E-7 transition = 1 type = 1 t1 = .15236 t2 = -.53571E-3 t3 = 665 t7 = 298.15 t8 = 931 end sap EoS = 1 | sapphirine MgO(2)Al2O3(2)SiO2(1) G0 = -5213954 S0 = 211.9312 V0 = 9.886 c1 = 514.953 c3 = -14720320 c5 = -2529.45 c7 = 1869221000 b2 = .214441E-3 b4 = -.4838374E-5 b7 = .4995198E-7 end