Carbon dioxide model

Takahashi, T., Broecker, W. S. and Bainbridge, A. E. (1981). The alkalinity and total carbon dioxide concentration in the world oceans. In "Carbon Dioxide Modeling" (B. Bolin, ed.), pp. 271-286. Wiley, New York. 

Table 17.7 Force field parameters for the developed C02(TIP3P), C02(TIP4P), and C02(TIP4P-Ew) carbon dioxide models ...

Most of the published studies on the reaction of ions with iron oxides have used samples of oxides which have been exposed to various extents to carbon dioxide. Models fitted to data from such studies do not reflect fundamental characteristics of the surface but are affected by the degree of exposure to carbon dioxide. In the case of goethite, most of the samples have consisted of multi-domainal crystals. It is only when such crystals have been healed by hydrothermal treatment that the true adsorption reactions of the surface can... 

Golomb D, Pennell S, Ryan D, Barry E, and Swett P (2007) Ocean sequestration of carbon dioxide Modeling the deep ocean release of a dense emulsion of liquid C02-in-water stabilized by pulverized limestone... 

Figure 7. The fits to the experimental isotherm for Vulcan using the single-site carbon dioxide model (solid line) and the multiple-site carbon dioxide model (dashed line).

Martinez, J Rosa, PTV Meireles, MAA. Extraction of clove and vetiver oils with supercritical carbon dioxide modeling and simulation. The Open Chemical Engineering Journal, 2007 1, 1-7. 

Figure 5.31 shows a dependence of fuel composition containing a mixture of hydrogen and carbon dioxide modeled by a 3-2-1 network, the training data also contained dry hydrogen and dry carbon monoxide. 

The permachor method is an empirical method for predicting the permeabiUties of oxygen, nitrogen, and carbon dioxide in polymers (29). In this method a numerical value is assigned to each constituent part of the polymer. An average number is derived for the polymer, and a simple equation converts the value into a permeabiUty. This method has been shown to be related to the cohesive energy density and the free volume of the polymer (2). The model has been modified to liquid permeation with some success. 

Temperature, pH, and feed rate are often measured and controlled. Dissolved oxygen (DO) can be controlled using aeration, agitation, pressure, and/or feed rate. Oxygen consumption and carbon dioxide formation can be measured in the outgoing air to provide insight into the metaboHc status of the microorganism. No rehable on-line measurement exists for biomass, substrate, or products. Most optimization is based on empirical methods simulation of quantitative models may provide more efficient optimization of fermentation. 

Hostomsky, J. and Jones, A.G., 1993c. Ibid., Modelling of calcium carbonate precipitation in the reaction between gaseous carbon dioxide and aqueous solution of calcium hydroxide. Indem. pp. 2055-2059. 

The coupling of supercritical fluid extraction (SEE) with gas chromatography (SEE-GC) provides an excellent example of the application of multidimensional chromatography principles to a sample preparation method. In SEE, the analytical matrix is packed into an extraction vessel and a supercritical fluid, usually carbon dioxide, is passed through it. The analyte matrix may be viewed as the stationary phase, while the supercritical fluid can be viewed as the mobile phase. In order to obtain an effective extraction, the solubility of the analyte in the supercritical fluid mobile phase must be considered, along with its affinity to the matrix stationary phase. The effluent from the extraction is then collected and transferred to a gas chromatograph. In his comprehensive text, Taylor provides an excellent description of the principles and applications of SEE (44), while Pawliszyn presents a description of the supercritical fluid as the mobile phase in his development of a kinetic model for the extraction process (45). 

Heat transfer in the furnace is mainly by radiation, from the incandescent particles in the flame and from hot radiating gases such as carbon dioxide and water vapor. The detailed theoretical prediction of overall radiation exchange is complicated by a number of factors such as carbon particle and dust distributions, and temperature variations in three-dimensional mixing. This is overcome by the use of simplified mathematical models or empirical relationships in various fields of application. 

The transformation of the hydrophobic periphery composed of bromo substituents into a hydrophilic wrapping of carboxylic acid functions was achieved by reacting 31 with (i) n-butyllithium and (ii) carbon dioxide. The polymer-analogous transformation provides water soluble, amphiphilic derivatives of 31 which constitute useful covalently bonded unimolecular models for micellar structures. 

Tadaki and Maeda (Tl) examined the desorption of carbon dioxide from water in a bubble-column and analyzed the experimental results under the assumption that while the gas phase moves in piston flow, the liquid undergoes axial mixing that can be characterized by the diffusion model. (Shulman and Molstad, in contrast, assumed piston flow for both phases.) Only poor agreement was obtained between the theoretical model and the experimental... 

Emmert and Pigford (E2) have studied the reaction between carbon dioxide and aqueous solutions of monoethanolamine (MEA) and report that the reaction rate constant is 5400 liter/mole sec at 25°C. If it is assumed that MEA is present in excess, the reaction may be treated as pseudo first-order. This pseudo first-order reaction has been recently used by Johnson et al. (J4) to study the rate of absorption from single carbon dioxide bubbles under forced convection conditions, and the results were compared with their theoretical model. 

Prentice, K. C. The Influence of the Terrestrial Biosphere on Seasonal Atmospheric Carbon Dioxide An Empirical Model Ph.D. Dissertation, Columbia University, New York, NY, 1986. 

Fan, S., Gloor, M., Mahlman, J., Pacala, S., Sarmiento, ]., Takahashi, T., and Tans, P. (1998). A large terrestrial carbon sink in North America implied by atmospheric and oceanic carbon dioxide data and models. Science 282, 442-446. 

An important example of non-linearity in a biogeochemical cycle is the exchange of carbon dioxide between the ocean surface water and the atmosphere and between the atmosphere and the terrestrial system. To illustrate some effects of these non-linearities, let us consider the simplified model of the carbon cycle shown in Fig. 4-12. Ms represents the sum of all forms of dissolved carbon (CO2, H2CO3, HCOi" and... 

Fig. 11-9 (a) The vertical distributions of alkalinity (Aik) and dissolved inorganic carbon (DIC) in the world oceans. Ocean regions shown are the North Atlantic (NA), South Atlantic (SA), Antarctic (AA), South Indian (SI), North Indian (NI), South Pacific (SP), and North Pacific (NP) oceans. (Modified with permission from T. Takahashi et ah, The alkalinity and total carbon dioxide concentration in the world oceans, in B. Bolin (1981). Carbon Cycle Modelling," pp. 276-277, John Wiley, Chichester.)... 

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