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Antti Roine HSC Chemistry® 7.0 10 - 3 August 10, 2006 09006-ORC-J ΔH = H(species) - ΣH(elements) ΔS =S(species)-ΣS(elements) ΔG = G(species) - ΣG(elements) ΔG = G(ions) - ΣG(elements) + z/2*G(H2(g)) - z*G(H(+a)) z =charge. This format is used for example in the NBS TablesNBS 82. 5. The Collect to Sheet option will collect several tables on the same spreadsheet. 6. Select the Show Transitions option if you also want to see the data at the phase transformation temperatures, such as crystal structure changes and melting. 7. Select the Criss-Cobble option if you want a Criss-Cobble extrapolation for the heat capacity of aqueous species, see Chapter 21.4. 8. Press Calculate (or Enter) to get the results on the screen. 9. Press Print to print the results, see Fig. 2. Note that you can collect several sets of results in the same sheet if you have selected the Collect to Sheet option in Fig. 1. You can clear the whole sheet by pressing Clear. 10. Press Copy All to get all the results into the Clipboard, then you can easily paste the results to other Windows applications, for example, to MS-Excel, see Fig. 2. Using Copy it is possible to copy and paste contents of individual cells to other applications. 11. If you want to save the formula and results in an ASCII-file press Save, see Fig. 2. You can read these files back to the Reaction module using File Open, see Fig. 1. Note that Save saves all the selections in Fig. 1, so you can return these using File Open. The File Open HSC 2 File button reads only old HSC 2.0 files which return only formula, but not the selections nor temperature range. Note: 1. You can easily check the basic data from the database, which has been used in the reaction module calculations. In Fig. 1 select the formula in the Reaction Equation box and press Peep Database. The same procedure can be found in Fig. 2 by pressing the right mouse button or selecting Edit from the menu. 2. The table in Fig. 2 has some formatting and Copy - Paste functions as do other tables in HSC Chemistry. These features help to create a good printed copy of the results for various purposes. 3. HSC searches for the species data first from the Own database (OwnDB7.HSC). If it does not find a species there, it will search from the Main database (MainDB7.HSC). Therefore HSC always uses data in the Own database if the same species exists in both Own and Main databases. 4. If you have selected Delta-format for the results, HSC will also search for data for the necessary elements and calculate the formation functions of enthalpy, entropy and Gibbs energy. Usually the original experimental data is in this format: however, sometimes the comparison of data in this format may be more difficult because the data sources often use different data for elements. 5. HSC will make a Criss-Cobble extrapolation for the heat capacity of aqueous species at elevated temperatures (> 25 C°) if the Criss-Cobble option is selected. The extrapolation is not done if A and B of the heat capacity coefficients A, B, CPDF Image | REACTION EQUATIONS
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