Right-click on unit field to convert units GSS is a spreadsheet for manipulating and plotting...

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0 2 4 6 8 10 12 14 –90 –80 –70 –60 –50 –40 –30 –20 –10 0 pH log fO 2 (g) U ++++ UO 2 + UO 2 ++ (UO 2 ) 3 (O H) 7 - U(O H) 5 - UO 2 OH + UOH +++ U 4 O 9 (c) U raninite 25°C

description

Select a mineral then click Apply Calculated saturation indices added to spreadsheet + analyte → Calculate… Enter chemical data for one or more samples in GSS, then perform geochemical calculations.

Transcript of Right-click on unit field to convert units GSS is a spreadsheet for manipulating and plotting...

Page 1: Right-click on unit field to convert units GSS is a spreadsheet for manipulating and plotting geochemical data.

0 2 4 6 8 10 12 14–90

–80

–70

–60

–50

–40

–30

–20

–10

0

pH

log

f O2(

g)

U++++

UO2+

UO2++

(UO2)3(OH)7-

U(OH)5-

UO2OH+

UOH+++

U4O9(c)

Uraninite

25°C

Page 2: Right-click on unit field to convert units GSS is a spreadsheet for manipulating and plotting geochemical data.

Right-click on unit field to convert units

GSS is a spreadsheet for manipulating and plotting geochemical data.

Page 3: Right-click on unit field to convert units GSS is a spreadsheet for manipulating and plotting geochemical data.

Select a mineral then click Apply

Calculated saturation indices added to spreadsheet+ analyte →

Calculate…

Enter chemical data for one or more samples in GSS, then perform geochemical calculations.

Page 4: Right-click on unit field to convert units GSS is a spreadsheet for manipulating and plotting geochemical data.

Graphs → Time Series PlotYou can display your data in

Time Series and XY plots

Page 5: Right-click on unit field to convert units GSS is a spreadsheet for manipulating and plotting geochemical data.

You can choose from a variety of water chemistry plots

Graphs → Piper Diagram

Page 6: Right-click on unit field to convert units GSS is a spreadsheet for manipulating and plotting geochemical data.

Rxn balances chemical reactions and calculates equilibrium constants, equilibrium equations, and more.

Move to the Results pane.

Rxn writes a reaction with Pyrite on the left side, balanced by the default basis species

Rxn will automatically add its default set of species.

Choose species to appear on left side of reaction.

Page 7: Right-click on unit field to convert units GSS is a spreadsheet for manipulating and plotting geochemical data.

Fe(OH)3(ppd) has been swapped in for Fe++

O2(g) swapped in for O2(aq)

Recast the reaction by performing basis swaps. Click to swap out an entry, then choose a species to replace it

The reaction is automatically rebalanced in terms of a ferric iron mineral and O2(g).

Page 8: Right-click on unit field to convert units GSS is a spreadsheet for manipulating and plotting geochemical data.

Run → Go draws the diagram

Add any background ions

Select main species to diagram

Choose axes

Act2 generates stability diagrams on activity, Eh, pe, pH, and fugacity axes

Page 9: Right-click on unit field to convert units GSS is a spreadsheet for manipulating and plotting geochemical data.

Move to the Plot pane.

Minerals plot in gold, aqueous species in blue

You can copy the diagram to the clipboard and paste

into your documents

Page 10: Right-click on unit field to convert units GSS is a spreadsheet for manipulating and plotting geochemical data.

Equilibrium point of the methane souring reaction, calculated as a function of temperature.

CH4(g) + Anhydrite ↔ Calcite + H2O + H2S(g)

Tact makes temperature-activity and temperature-fugacity diagrams

Page 11: Right-click on unit field to convert units GSS is a spreadsheet for manipulating and plotting geochemical data.

Enter your fluid composition on the Basis pane

Click to add new entries

Set temperature

Set dissolved concentrations in units of your choice

Swap in gases of known fugacity, or minerals at

equilibrium

SpecE8 figures concentrations of aqueous and sorbed species, mineral saturation, and gas fugacity

Page 12: Right-click on unit field to convert units GSS is a spreadsheet for manipulating and plotting geochemical data.

Species listed in order of molal concentration

Activity coefficients

Species activities

View results as a text file…

Page 13: Right-click on unit field to convert units GSS is a spreadsheet for manipulating and plotting geochemical data.

Set “Variable type”, then choose from the

list of variables

… or plot results in Gtplot

Set X and Y axes

Page 14: Right-click on unit field to convert units GSS is a spreadsheet for manipulating and plotting geochemical data.

TEdit is a graphical application for quickly and accurately editing and combining thermodynamic datasets.

Entry for the mineral Hematite (Fe2O3)

Reaction, log K at the principal temperatures