Abstract
Despite chemical knowledge about CO2 that extends back centuries, some data bases are still evolving that are needed to predict even the sub-critical CO2 behavior down the geothermal gradient's P- and T-values which will be encountered in sequestration utilizing deep mines and wells. These needed data include IR-spectral interpretations of CO2 molecular structure as P and T change; the unraveling of the Joule Thomson coefficient (heating or cooling?) that changes algebraic polarity around 106 Pa; more exact equations of state (EOS) that correlate to potential CO2 polarity changes in molecular structure; newer EOS than those that have currently been derived by templating directly measured data; and focus is needed on the EOS-derived properties, like fugacity. Also, natural analogues like (1) the carbonate stability in metamorphic silicate-carbonation facies and (2) Lake Nyos aqueous geochemistry with concern about the potential redox-equilibria-predicted presence of CO (and graphite), as well as CO2.
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