D:\jamie\Berple_X>build NO is the default () answer to all Y/N prompts Enter name of computational option file to be created, < 100 characters, left justified [default = in]: in11.dat Enter thermodynamic data file name, left justified, [default = hp98ver.dat]: hp98ver.dat The current data base components are: NA2O MGO AL2O3 SIO2 K2O CAO TIO2 MNO FEO O2 H2O CO2 Transform them (Y/N)? n Calculations with a saturated phase (Y/N)? The phase is: FLUID Its compositional variable is: Y(CO2), X(O), etc. y Select the independent saturated phase components: H2O CO2 Enter names, left justified, 1 per line, to finish: For C-O-H fluids it is only necessary to select volatile species present in the solids of interest. If the species listed here are H2O and CO2, then to constrain O2 chemical potential to be consistent with C-O-H fluid speciation treat O2 as a saturated component. Refer to the Perple_X Tutorial for details. H2O CO2 Calculations with saturated components (Y/N)? y **warning ver015** if you select > 1 saturated component, then the order you enter the components determines the saturation heirarchy and may effect your results (see Connolly 1990). Select < 6 saturated components from the set: NA2O MGO AL2O3 SIO2 K2O CAO TIO2 MNO FEO O2 Enter names, left justified, 1 per line, to finish: O2 SIO2 AL2O3 Use chemical potentials, activities or fugacities as independent variables (Y/N)? n Select thermodynamic components from the set: NA2O MGO K2O CAO TIO2 MNO FEO Enter names, left justified, 1 per line, to finish: CAO FEO 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 12 Choose a buffer: 1 - Pyrite + Pyrrhotite 2 - Pyrrhotite 3 - f(S2) 2 Enter atomic Fe/S of pyrrhotite: 0.93 Compute f(H2) & f(O2) as the dependent fugacities (do not unless you project through carbon) (Y/N)? n Reduce graphite activity (Y/N)? n The data base has P(bars) and T(K) as default independent potentials. Make one dependent on the other, e.g., as along a geothermal gradient (y/n)? n Specify computational mode: 1 - Unconstrained minimization [default] 2 - Constrained minimization on a grid 3 - Output pseudocompound data Unconstrained optimization should be used for the calculation of composition, mixed variable, and Schreinemakers diagrams, it may also be used for the calculation of phase diagram sections for a fixed bulk composition. Gridded minimization can be used to construct phase diagram sections for both fixed and variable bulk composition. Gridded minimization is preferable for the recovery of phase and bulk properties. 1 Specify number of independent potential variables: 0 - Composition diagram [default] 1 - Mixed-variable diagram 2 - Sections and Schreinemakers-type diagrams 2 Select x-axis variable: 1 - P(bars) 2 - T(K) 3 - X(O) 3 Enter minimum and maximum values, respectively, for: X(O) 0.2 1 Select y-axis variable: 2 - T(K) 3 - P(bars) 2 Enter minimum and maximum values, respectively, for: T(K) 753 873 Specify sectioning value for: P(bars) 6000 Constrain bulk composition (as in pseudosections, y/n)? n Do you want a print file (Y/N)? y Enter the print file name, < 100 characters, left justified [default = pr]: print11 Long print file format (Y/N)? n Write full reaction equations (Y/N)? n Suppress console status messages (Y/N)? n Print dependent potentials for chemographies (Y/N)? Answer no if you do not know what this means. n Do you want a plot file (Y/N)? y Enter the plot file name, < 100 characters, left justified [default = pl]: plot11 Specify efficiency level [1-5, default = 3]: 1 - gives lowest efficiency, highest reliability 5 - gives highest efficiency, lowest reliability High values increase probability that a curve may be partially determined or skipped. **warning ver013** phase iron has null or negative composition and will be rejected from the composition space. **warning ver013** phase gph has null or negative composition and will be rejected from the composition space. **warning ver013** phase diam has null or negative composition and will be rejected from the composition space. **warning ver013** phase CO has null or negative composition and will be rejected from the composition space. **warning ver013** phase CH4 has null or negative composition and will be rejected from the composition space. **warning ver013** phase H2 has null or negative composition and will be rejected from the composition space. Exclude phases (Y/N)? n Do you want to treat solution phases (Y/N)? y Enter solution model file name [default = solut.dat] left justified, < 100 characters: solut.dat **warning ver113** F is not a valid model because component H2O or CO2 is constrained or missing ... blah blah ... **warning ver025** 1 endmembers for MnCtd The solution will not be considered. Select phases from the following list, enter 1 per line, left justified, to finish aChl Chl sChl T hCrd TrTs TrTsPg GlTrTs CzEpPs EpCz Opx(HP) Cpx(l) Cpx(h) GrAd(EW) GrAd GrPyAlSp(B GrPyAlSp(G GrPyAl(G) GtD Gt(HP) GrPyAl(B) trgltsch Mn-Opx(HP) MnChl Gt(HP) EpCz Calculate high variance phase fields (Y/N)? y Enter calculation title: Test Problem 11 D:\jamie\Berple_X>vertex Enter computational option file name (i.e. the file created with BUILD), left justified: in11.dat Reading thermodynamic data from file: hp98ver.dat Writing print output to file: print11 Writing plot output to file: plot11 Reading solution models from file: solut.dat **warning ver013** phase iron has a negative composition and will be rejected from the saturated-component composition space. **warning ver013** phase gph has a negative composition and will be rejected from the saturated-component composition space. **warning ver013** phase diam has a negative composition and will be rejected from the saturated-component composition space. **warning ver013** phase CO has a negative composition and will be rejected from the saturated-component composition space. **warning ver013** phase CH4 has a negative composition and will be rejected from the saturated-component composition space. **warning ver013** phase H2 has a negative composition and will be rejected from the saturated-component composition space. **warning ver114** the following endmembers are missing for Gt(HP) py spss **warning ver501** Gt(HP) will be recast with endmembers: 111 - alm 211 - gr cycle 1 1 1 Initial number of divariant assemblages to be tested is: 1 Testing divariant assemblage 1, 0 assemblages remaining to be tested. finished with equilibrium ( 1) sid = fctd finished with equilibrium ( 2) fctd = fst finished with equilibrium ( 3) sid = fst finished with equilibrium ( 4) ma = an finished with equilibrium ( 4) ma = an finished with equilibrium ( 3) sid = fst finished with equilibrium ( 5) ank = ma sid finished with equilibrium ( 4) ma = an finished with equilibrium ( 6) ank = sid an finished with equilibrium ( 7) sid an = Gt(HP)(al80) finished with equilibrium ( 3) sid = fst finished with equilibrium ( 8) an fst = Gt(HP)(al80) finished with equilibrium ( 9) cc = ma finished with equilibrium ( 10) cc = an finished with equilibrium ( 11) sid an = Gt(HP)(al84) finished with equilibrium ( 12) sid Gt(HP)(al80) = Gt(HP)(al84) finished with equilibrium ( 13) Gt(HP)(al80) = an Gt(HP)(al84) finished with equilibrium ( 3) sid = fst finished with equilibrium ( 14) Gt(HP)(al80) fst = Gt(HP)(al84) finished with equilibrium ( 15) an fst = Gt(HP)(al84) finished with equilibrium ( 16) sid Gt(HP)(al84) = Gt(HP)(al87) finished with equilibrium ( 3) sid = fst finished with equilibrium ( 17) Gt(HP)(al84) fst = Gt(HP)(al87) finished with equilibrium ( 18) sid Gt(HP)(al87) = Gt(HP)(al91) finished with equilibrium ( 3) sid = fst finished with equilibrium ( 19) Gt(HP)(al87) fst = Gt(HP)(al91) finished with equilibrium ( 20) sid Gt(HP)(al91) = Gt(HP)(al94) finished with equilibrium ( 3) sid = fst finished with equilibrium ( 21) Gt(HP)(al91) fst = Gt(HP)(al94) finished with equilibrium ( 22) sid Gt(HP)(al94) = Gt(HP)(al98.0) finished with equilibrium ( 3) sid = fst finished with equilibrium ( 23) Gt(HP)(al94) fst = Gt(HP)(al98.0) finished with equilibrium ( 24) sid = Gt(HP)(alm) finished with equilibrium ( 25) fst = Gt(HP)(alm) Metastable assemblage in FLIPIT the assemblage is: ma fctd v = 6000.00 836.449 0.200000 0.00000 0.00000 Testing divariant assemblage 2, 0 assemblages remaining to be tested. Testing divariant assemblage 3, 1 assemblages remaining to be tested. Testing divariant assemblage 4, 1 assemblages remaining to be tested. Testing divariant assemblage 5, 1 assemblages remaining to be tested. Testing divariant assemblage 6, 2 assemblages remaining to be tested. Testing divariant assemblage 7, 2 assemblages remaining to be tested. Testing divariant assemblage 8, 2 assemblages remaining to be tested. Testing divariant assemblage 9, 3 assemblages remaining to be tested. Testing divariant assemblage 10, 2 assemblages remaining to be tested. Testing divariant assemblage 11, 2 assemblages remaining to be tested. Testing divariant assemblage 12, 3 assemblages remaining to be tested. Testing divariant assemblage 13, 3 assemblages remaining to be tested. Testing divariant assemblage 14, 2 assemblages remaining to be tested. Testing divariant assemblage 15, 3 assemblages remaining to be tested. Testing divariant assemblage 16, 3 assemblages remaining to be tested. Metastable assemblage in FLIPIT the assemblage is: al84 fst v = 6000.00 873.000 0.439999 0.00000 0.00000 Testing divariant assemblage 17, 2 assemblages remaining to be tested. Testing divariant assemblage 18, 3 assemblages remaining to be tested. Testing divariant assemblage 19, 3 assemblages remaining to be tested. Testing divariant assemblage 20, 2 assemblages remaining to be tested. Testing divariant assemblage 21, 2 assemblages remaining to be tested. Testing divariant assemblage 22, 2 assemblages remaining to be tested. Testing divariant assemblage 23, 1 assemblages remaining to be tested. Testing divariant assemblage 24, 1 assemblages remaining to be tested. Testing divariant assemblage 25, 0 assemblages remaining to be tested. D:\jamie\Berple_X>psvdraw Enter the VERTEX plot file name: plot11 PostScript will be written to file: plot11.ps Modify the default plot (y/n)? D:\jamie\Berple_X>