Spreadsheet for geochemical data |
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Convert chemical units |
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Time series, cross, and ternary plots |
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Piper, Stiff, Durov, Schoeller diagrams |
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Configure Stiff, Schoeller, and Radial diagrams from user interface |
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Multiple Stiff, Schoeller, Radial, Bar, and Pie plots per page |
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Show TDS as circles of varying radius on Piper, other plots |
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Ion balance bar and pie charts |
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Plots update in real time as you edit a datasheet |
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Flag non-compliance |
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Evaluate equations within datasheets |
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Calculate mineral saturation and gas fugacity |
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Mix samples |
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Compare replicates and check standards |
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Calculate redox state |
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Check charge balance |
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Compute TDS |
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Eh-pH, activity, and fugacity diagrams |
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Temperature-activity and temperature-fugacity diagrams |
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Solubility diagrams |
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Mosaic (ligand speciation) diagrams |
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Hover to see reactions, assemblages |
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Calculate species’ concentration and activity coefficients |
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Redox equilibrium and disequilibrium |
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Use “Pitzer equations” to compute activity coefficients |
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Evaluate “Pitzer equations” at high temperature |
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Activity coefficients by the SIT method |
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Sorption by Kd, Freundlich, and Langmuir models |
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Ion exchange |
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Two-layer and 1-pKa surface complexation |
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Triple-layer and CD-MUSIC surface chemistry |
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Polydentate surface complexes |
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Ideal and Guggenheim solid solutions |
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Stable isotope fractionation |
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Calculate electrical conductivity by USGS and APHA methods |
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Gas and mineral buffering; pH-stat |
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Partial pressure model |
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Balance chemical reactions |
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Compute equilibrium constants (log Ks) at temperature |
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Derive equilibrium equations, temperatures |
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Set line colors individually on x-y plots |
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Paste graphs into Word, PowerPoint, Excel, Adobe Illustrator |
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Choose 32 bit or even faster 64 bit version |
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Edit and combine thermodynamic datasets |
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Change redox coupling in thermo datasets |
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Import thermo datasets from PhreeqC |
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Create and edit datasets of surface reactions |
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Flexible redox pivoting in thermodynamic datasets |
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Dashboard keeps all your tools in one place |
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Save graphics as eps, pdf, ai, png, emf, svg, and bmp files |
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Plug-in to other programs |
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Control scripts and batch processing |
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Edit thermo and surface datasets in legacy formats |
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Allow automatic maintenance updates |
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Model water-rock interaction |
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Simulate fluid mixing |
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Speciation diagrams vs. pH, etc. |
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Closed and open chemical systems |
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Polythermal simulations |
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Fixed and sliding activity, fugacity |
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Combine equilibrium and kinetic reactions |
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Kinetics of mineral precipitation and dissolution |
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Aqueous complexation and dissociation kinetics |
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Sorption and desorption kinetics |
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Kinetics of redox transformation |
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Enzymes and catalysts |
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Gas transfer kinetics |
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Microbial catalysis and growth |
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Mixed microbial communities |
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Thermodynamic constraint on microbial metabolism |
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Specify form of kinetic rate laws |
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Chain together kinetic reaction paths |
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Turbo scripting speeds rate law evaluation |
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Transient medium and fluid properties |
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Account for heat sources and sinks |
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Report factors limiting time steps |
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Paste any plot into Excel as numerical data |
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Compute phase and "true" speciation diagrams |
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Reactive and bioreactive transport |
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Multithreaded (parallel execution on multicore chips) |
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Advection, dispersion, and diffusion |
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Uniform or heterogeneous medium |
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Dual porosity (stagnant zones) |
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Advective and conductive heat transfer |
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Colloidal transport |
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Stable isotope transport |
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Any number of boundary, injection fluids |
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Unlimited number of reaction intervals |
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Turn wells off and on, vary pumping rates |
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Recirculation wells |
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Import flow fields |
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Linear, radial, and spherical coordinates in 1-D |
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Rectilinear and axisymmetric coordinates in 2-D |
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Regular and adaptive grids |
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Map view, color mask, and contour plots |
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Animation and output for video |
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Quick video output to compact frame images |
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