Development of an experimental data base and theories for prediction of thermodynamic properties of aqueous electrolytes and nonelectrolytes of geochemical significance at supercritical temperatures and pressures. Annual performance report
This project is divided into method experimental measurements, theoretical development, and geochemical applications. We have completed experimental volumetric measurements on aqueous solutions of CO{sub 2} H{sub 2}S, CH{sub 4}, NH{sub 3} and B(OH){sub 3} at 25 to 432{degree}C and 280 and 350 bar. A...
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Delaware Univ., Newark, DE (United States). Dept. of Chemistry and Biochemistry
1992
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ftunivnotexas:info:ark/67531/metadc1400347 2023-05-15T15:52:30+02:00 Development of an experimental data base and theories for prediction of thermodynamic properties of aqueous electrolytes and nonelectrolytes of geochemical significance at supercritical temperatures and pressures. Annual performance report Wood, R. H. Hnedkovsky, L. Lin, Ching Lung Shock, E. L. United States. Department of Energy. 1992-02-24 20 p. Text https://doi.org/10.2172/10182216 https://digital.library.unt.edu/ark:/67531/metadc1400347/ English eng Delaware Univ., Newark, DE (United States). Dept. of Chemistry and Biochemistry other: DE92040856 rep-no: DOE/ER/14080--3 grantno: FG02-89ER14080 doi:10.2172/10182216 osti: 10182216 https://digital.library.unt.edu/ark:/67531/metadc1400347/ ark: ark:/67531/metadc1400347 Other Information: PBD: 24 Feb 1992 Progress Report Solubility Volume Bubbles Thermodynamic Properties Chemical And Physicochemical Properties 580000 58 Geosciences Methane Carbonic Acid Geosciences Hydrogen Sulfides Rock-Fluid Interactions 400201 Free Energy Boric Acid Aqueous Solutions Ammonia High Pressure Hydrothermal Systems Temperature Range 0400-1000 K Carbon Dioxide 37 Inorganic Organic Physical And Analytical Chemistry Density Geochemistry Very High Pressure Report 1992 ftunivnotexas https://doi.org/10.2172/10182216 2019-03-23T23:08:35Z This project is divided into method experimental measurements, theoretical development, and geochemical applications. We have completed experimental volumetric measurements on aqueous solutions of CO{sub 2} H{sub 2}S, CH{sub 4}, NH{sub 3} and B(OH){sub 3} at 25 to 432{degree}C and 280 and 350 bar. A vibrating tube densitometer that allows density measurements near bubble point and also measures the bubble pressure was developed and used to measure densities and bubble pressures of aqueous Co{sub 2}. Heat capacity measurements should be completed by the end of the grant period. Simulations of models for methane in water at temperatures to 1000{degrees}C are in progress. In order to facilitate these free energy calculations the possible errors associated with the calculations have been explored in two papers (Wood, 1991; Wood et al., 1991) and methods of controlling and estimating these errors have been developed. Applications of the new data to geochemical processes is now possible. Efforts have focussed on extracting equilibrium constants for carbonic acid dissociation at supercritical condition from published experiments on mineral equilibria in H{sub 2}0-CO{sub 2} fluids (Boehlke and Shock, 1990; and in prep.). As a result, estimates of pKa for carbonic acid are now available at temperatures from 300 to 750{degrees}C and pressures from 1 to 7 kilobars. They will be combined with {bar V}{sup {degree}} and {bar C}p{sup {degree}} data for CO{sup 2}(aq) to improve geochemical calculations. Report Carbonic acid University of North Texas: UNT Digital Library |
institution |
Open Polar |
collection |
University of North Texas: UNT Digital Library |
op_collection_id |
ftunivnotexas |
language |
English |
topic |
Progress Report Solubility Volume Bubbles Thermodynamic Properties Chemical And Physicochemical Properties 580000 58 Geosciences Methane Carbonic Acid Geosciences Hydrogen Sulfides Rock-Fluid Interactions 400201 Free Energy Boric Acid Aqueous Solutions Ammonia High Pressure Hydrothermal Systems Temperature Range 0400-1000 K Carbon Dioxide 37 Inorganic Organic Physical And Analytical Chemistry Density Geochemistry Very High Pressure |
spellingShingle |
Progress Report Solubility Volume Bubbles Thermodynamic Properties Chemical And Physicochemical Properties 580000 58 Geosciences Methane Carbonic Acid Geosciences Hydrogen Sulfides Rock-Fluid Interactions 400201 Free Energy Boric Acid Aqueous Solutions Ammonia High Pressure Hydrothermal Systems Temperature Range 0400-1000 K Carbon Dioxide 37 Inorganic Organic Physical And Analytical Chemistry Density Geochemistry Very High Pressure Wood, R. H. Hnedkovsky, L. Lin, Ching Lung Shock, E. L. Development of an experimental data base and theories for prediction of thermodynamic properties of aqueous electrolytes and nonelectrolytes of geochemical significance at supercritical temperatures and pressures. Annual performance report |
topic_facet |
Progress Report Solubility Volume Bubbles Thermodynamic Properties Chemical And Physicochemical Properties 580000 58 Geosciences Methane Carbonic Acid Geosciences Hydrogen Sulfides Rock-Fluid Interactions 400201 Free Energy Boric Acid Aqueous Solutions Ammonia High Pressure Hydrothermal Systems Temperature Range 0400-1000 K Carbon Dioxide 37 Inorganic Organic Physical And Analytical Chemistry Density Geochemistry Very High Pressure |
description |
This project is divided into method experimental measurements, theoretical development, and geochemical applications. We have completed experimental volumetric measurements on aqueous solutions of CO{sub 2} H{sub 2}S, CH{sub 4}, NH{sub 3} and B(OH){sub 3} at 25 to 432{degree}C and 280 and 350 bar. A vibrating tube densitometer that allows density measurements near bubble point and also measures the bubble pressure was developed and used to measure densities and bubble pressures of aqueous Co{sub 2}. Heat capacity measurements should be completed by the end of the grant period. Simulations of models for methane in water at temperatures to 1000{degrees}C are in progress. In order to facilitate these free energy calculations the possible errors associated with the calculations have been explored in two papers (Wood, 1991; Wood et al., 1991) and methods of controlling and estimating these errors have been developed. Applications of the new data to geochemical processes is now possible. Efforts have focussed on extracting equilibrium constants for carbonic acid dissociation at supercritical condition from published experiments on mineral equilibria in H{sub 2}0-CO{sub 2} fluids (Boehlke and Shock, 1990; and in prep.). As a result, estimates of pKa for carbonic acid are now available at temperatures from 300 to 750{degrees}C and pressures from 1 to 7 kilobars. They will be combined with {bar V}{sup {degree}} and {bar C}p{sup {degree}} data for CO{sup 2}(aq) to improve geochemical calculations. |
author2 |
United States. Department of Energy. |
format |
Report |
author |
Wood, R. H. Hnedkovsky, L. Lin, Ching Lung Shock, E. L. |
author_facet |
Wood, R. H. Hnedkovsky, L. Lin, Ching Lung Shock, E. L. |
author_sort |
Wood, R. H. |
title |
Development of an experimental data base and theories for prediction of thermodynamic properties of aqueous electrolytes and nonelectrolytes of geochemical significance at supercritical temperatures and pressures. Annual performance report |
title_short |
Development of an experimental data base and theories for prediction of thermodynamic properties of aqueous electrolytes and nonelectrolytes of geochemical significance at supercritical temperatures and pressures. Annual performance report |
title_full |
Development of an experimental data base and theories for prediction of thermodynamic properties of aqueous electrolytes and nonelectrolytes of geochemical significance at supercritical temperatures and pressures. Annual performance report |
title_fullStr |
Development of an experimental data base and theories for prediction of thermodynamic properties of aqueous electrolytes and nonelectrolytes of geochemical significance at supercritical temperatures and pressures. Annual performance report |
title_full_unstemmed |
Development of an experimental data base and theories for prediction of thermodynamic properties of aqueous electrolytes and nonelectrolytes of geochemical significance at supercritical temperatures and pressures. Annual performance report |
title_sort |
development of an experimental data base and theories for prediction of thermodynamic properties of aqueous electrolytes and nonelectrolytes of geochemical significance at supercritical temperatures and pressures. annual performance report |
publisher |
Delaware Univ., Newark, DE (United States). Dept. of Chemistry and Biochemistry |
publishDate |
1992 |
url |
https://doi.org/10.2172/10182216 https://digital.library.unt.edu/ark:/67531/metadc1400347/ |
genre |
Carbonic acid |
genre_facet |
Carbonic acid |
op_source |
Other Information: PBD: 24 Feb 1992 |
op_relation |
other: DE92040856 rep-no: DOE/ER/14080--3 grantno: FG02-89ER14080 doi:10.2172/10182216 osti: 10182216 https://digital.library.unt.edu/ark:/67531/metadc1400347/ ark: ark:/67531/metadc1400347 |
op_doi |
https://doi.org/10.2172/10182216 |
_version_ |
1766387662364606464 |