c:\jamie\Berple_X>species Select fluid equation of state: 0 - X(CO2) Modified Redlich-Kwong (MRK/DeSantis/Holloway) 1 - X(CO2) Kerrick & Jacobs 1981 (HSMRK) 2 - X(CO2) Hybrid MRK/HSMRK 3 - X(CO2) Saxena & Fei 1987 pseudo-virial expansion 4 - Bottinga & Richet 1981 (CO2 RK) 5 - X(CO2) Holland & Powell 1991, 1998 (CORK) 6 - X(CO2) Hybrid Haar et al 1979/CORK (TRKMRK) 7 - f(O2/CO2)-f(S2) Graphite buffered COHS MRK fluid 8 - f(O2/CO2)-f(S2) Graphite buffered COHS hybrid-EoS fluid 9 - Max X(H2O) GCOH fluid Cesare & Connolly 1993 10 - X(O) GCOH-fluid hybrid-EoS Connolly & Cesare 1993 11 - X(O) GCOH-fluid MRK Connolly & Cesare 1993 12 - X(O)-f(S2) GCOHS-fluid hybrid-EoS Connolly & Cesare 1993 13 - X(H2) H2-H2O hybrid-EoS 14 - EoS Birch & Feeblebop (1993) 15 - X(H2) low T H2-H2O hybrid-EoS 16 - X(O) H-O HSMRK/MRK hybrid-EoS 17 - X(O) H-O-S HSMRK/MRK hybrid-EoS 18 - X(CO2) Delany/HSMRK/MRK hybrid-EoS, for P > 10 kb 19 - X(O)-X(S) COHS hybrid-EoS Connolly & Cesare 1993 20 - X(O)-X(C) COHS hybrid-EoS Connolly & Cesare 1993 21 - X(CO2) Halbach & Chatterjee 1982, P > 10 kb, hybrid-Eos 22 - X(CO2) DHCORK, hybrid-Eos 23 - Toop-Samis Silicate Melt 24 - f(O2/CO2)-N/C Graphite saturated COHN MRK fluid 24 Modify default buffer (max H2O) (Y/N)? y Select buffer: 1 - aQFM, 298-1200K 2 - Maximum H2O content, 523-1273K, .5-30kbar 3 - user specified f(O2) 4 - aQ-Ru-Cc-Tn-Gph 5 - ln(f(O2))= a + (b + c*p)/t + d/t**2 + e/t**3 3 Enter log10[f(O2)]: -30 this number means nothing Plot (log) species fractions (y/n)? (if you answer no, then fugacities are plotted). y lg f(O2) is log10[f(O2)] Enter pressure (bar), temperature (K): 1000 1000 Enter molar N/C ratio and log10[a(graphite)]: 0.01 0 Enter min, max, and increments for the independent variable (lg f(O2) ): -21 -17 0.1 Enter min-max (log) limits for the dependent variables, in the plot file, values that exceed these limits will be set to the limits established here: -4 0 values which follow are lg f(O2) and the mole fractions of: H2O CO2 CO CH4 H2 N2 NH3 and log10(fO2). the plot file includes the log of the C-O-H-S-N atomic proportions and the log of the species fractions. 0.00000 0.417333E-01 0.393186E-03 0.723681E-03 0.866832 0.817274E-01 0.889315E-04 0.850162E -21.0000 0.00000 0.467465E-01 0.495685E-03 0.811770E-03 0.861972 0.814307E-01 0.885844E-04 0.845563E -20.9000 0.00000 0.523504E-01 0.625006E-03 0.910545E-03 0.856523 0.810976E-01 0.881978E-04 0.840419E -20.8000 0.00000 0.586114E-01 0.788207E-03 0.102129E-02 0.850420 0.807237E-01 0.877682E-04 0.834676E -20.7000 0.00000 0.656026E-01 0.994220E-03 0.114545E-02 0.843583 0.803040E-01 0.872914E-04 0.828264E -20.6000 0.00000 0.734039E-01 0.125435E-02 0.128461E-02 0.835927 0.798329E-01 0.867631E-04 0.821113E -20.5000 0.00000 0.821022E-01 0.158293E-02 0.144058E-02 0.827352 0.793040E-01 0.861785E-04 0.813140E -20.4000 0.00000 0.917920E-01 0.199810E-02 0.161533E-02 0.817757 0.787104E-01 0.855337E-04 0.804264E -20.3000 0.00000 0.102575 0.252287E-02 0.181109E-02 0.807019 0.780438E-01 0.848238E-04 0.794389E -20.2000 0.00000 0.114559 0.318647E-02 0.203032E-02 0.795011 0.772956E-01 0.840453E-04 0.783419E -20.1000 0.00000 0.127859 0.402594E-02 0.227572E-02 0.781587 0.764555E-01 0.831949E-04 0.771250E -20.0000 0.00000 0.142594 0.508837E-02 0.255031E-02 0.766595 0.755128E-01 0.822710E-04 0.757780E -19.9000 0.00000 0.158885 0.643357E-02 0.285738E-02 0.749860 0.744547E-01 0.812734E-04 0.742897E -19.8000 0.00000 0.176851 0.813750E-02 0.320054E-02 0.731199 0.732672E-01 0.802052E-04 0.726496E -19.7000 0.00000 0.196611 0.102967E-01 0.358364E-02 0.710412 0.719327E-01 0.790696E-04 0.708478E -19.6000 0.00000 0.218242 0.130337E-01 0.401107E-02 0.687304 0.704421E-01 0.778957E-04 0.688770E -19.5000 0.00000 0.241838 0.165040E-01 0.448713E-02 0.661651 0.687690E-01 0.766928E-04 0.667304E -19.4000 0.00000 0.267421 0.209043E-01 0.501657E-02 0.633247 0.668964E-01 0.755050E-04 0.644067E -19.3000 0.00000 0.294957 0.264827E-01 0.560420E-02 0.601887 0.648032E-01 0.743926E-04 0.619096E -19.2000 0.00000 0.324320 0.335512E-01 0.625485E-02 0.567407 0.624685E-01 0.734497E-04 0.592523E -19.1000 0.00000 0.355252 0.424985E-01 0.697323E-02 0.529686 0.598716E-01 0.728209E-04 0.564593E -19.0000 0.00000 0.387307 0.538057E-01 0.776380E-02 0.488698 0.569947E-01 0.727318E-04 0.535721E -18.9000 0.00000 0.419793 0.680603E-01 0.863076E-02 0.444551 0.538251E-01 0.735411E-04 0.506534E -18.8000 0.00000 0.451689 0.859696E-01 0.957836E-02 0.397549 0.503590E-01 0.758360E-04 0.477930E -18.7000 0.00000 0.481567 0.108371 0.106119E-01 0.348252 0.466058E-01 0.806177E-04 0.451112E -18.6000 0.00000 0.507519 0.136245 0.117397E-01 0.297539 0.425933E-01 0.896856E-04 0.427586E -18.5000 0.00000 0.527115 0.170729 0.129772E-01 0.246615 0.383683E-01 0.106475E-03 0.409026E -18.4000 0.00000 0.537412 0.213172 0.143528E-01 0.196963 0.339937E-01 0.137997E-03 0.396889E -18.3000 0.00000 0.535004 0.265235 0.159154E-01 0.150197 0.295357E-01 0.199444E-03 0.391458E -18.2000 0.00000 0.516072 0.329071 0.177425E-01 0.107853 0.250417E-01 0.324873E-03 0.389691E -18.1000 0.00000 0.476330 0.407599 0.199465E-01 0.712125E-01 0.205143E-01 0.588100E-03 0.381136E -18.0000 0.00000 0.410765 0.504845 0.226818E-01 0.412537E-01 0.158899E-01 0.112391E-02 0.343997E -17.9000 0.00000 0.313079 0.626368 0.261502E-01 0.187599E-01 0.110215E-01 0.209197E-02 0.252884E -17.8000 0.00000 0.174631 0.779873 0.306183E-01 0.458522E-02 0.566848E-02 0.352609E-02 0.109857E -17.7000 **warning ver222** routine COHNGR, specified fO2 (0.251189E-17) is inconsistent with graphite saturation at P(bar)= 1000.00 T(K)= 1000.00 XCO2=1 assumed. Change EoS, buffer, or graphite activity (y/n)? n c:\jamie\Berple_X>psvdraw Enter the Perple_X plot file name: species.dat PostScript will be written to file: species.dat.ps Modify the default plot (y/n)? End-of-file! if this is a VERTEX plot file then VERTEX terminated incorrectly c:\jamie\Berple_X>psvdraw Enter the Perple_X plot file name: GCOH_surf.dat PostScript will be written to file: GCOH_surf.dat.ps Modify the default plot (y/n)? n End-of-file! if this is a VERTEX plot file then VERTEX terminated incorrectly c:\jamie\Berple_X>