Interpretation of Activation Volumes for Water Exchange Reactions Revisited: AbInitioCalculations for Al3+, Ga3+, and In3+, and New Experimental Data

1998 ◽  
Vol 120 (26) ◽  
pp. 6569-6577 ◽  
Author(s):  
Th. Kowall ◽  
P. Caravan ◽  
H. Bourgeois ◽  
L. Helm ◽  
F. P. Rotzinger ◽  
...  
Author(s):  
Alexander S. Lelekov ◽  
Rudolf P. Trenkenshu

The paper presents an example of the linear splines use to describe the photosynthesis light curves for microalgae culture. The main mathematical models of the relationship between photosynthesis rate and light are listed. Based on the previously formulated basic principles of modeling microalgae photobiosynthesis, a mathematical model is proposed that describes the dependence of the assimilation number of chlorophyll a on the value of the light flux by linear splines. The advantage of the proposed approach is a clear definition of the point of change of the limiting factor. It is shown that light-limited photosynthesis rate is determined not only by external irradiation, but also by the concentration of chlorophyll a. The light-saturated rate depends on the amount of a key enzyme complex, which limits the rate of energy exchange reactions in the cell. Verification of the proposed model on the example of the diatom microalgae Skeletonema costatum was carried out. It is shown that the higher the degree of cell adaptation to high irradiation, the better the photosynthesis curve is described by linear splines. If S. costatum cells are adapted to low irradiation, deviations of experimental data from the idealized broken line are observed, which are caused by changes in the pigment composition. When the experimental data are normalized, the cell adaptation factor is reduced, all points are described by a single broken line, which indicates the universality of the proposed approach.


1997 ◽  
Vol 506 ◽  
Author(s):  
A V Chambers ◽  
T G Heath ◽  
C M Linklater ◽  
A M Thompson ◽  
R M Wiggin

ABSTRACTA model has been developed that can simulate in some detail the chemistry of the glass dissolution process. To test the performance of the model, calculations were carried out to predict the dissolution behaviour of a commercial borosilicate glass. The model could reproduce accurately the behaviour of major elements released from the glass, although in the case of silica, ‘sorption’ at the glass surface was required in order to achieve good agreement with experimental data. Secondary reaction products sepiolite, montmorillonite, analcime and goethite were predicted to form. Further calculations were carried out to simulate the release of radioelements (caesium, strontium, uranium, plutonium) from within the dissolving glass. The precipitation of insoluble solids was the only mechanism included in the model to retain the radioelements at the glass surface. For plutonium, there was good agreement between model predictions and available experimental data. For caesium and strontium, the model underestimated the amount of retention at the glass surface and additional retention mechanisms, such as coprecipitation or ion exchange reactions involving newly-formed clay-type minerals at the glass surface must be invoked to explain experimental observation.


1994 ◽  
Vol 116 (13) ◽  
pp. 5551-5559 ◽  
Author(s):  
Margaret V. Merritt ◽  
Dina B. Anderson ◽  
Kim A. Basu ◽  
I.-Wen Chang ◽  
Hee-Joo Cheon ◽  
...  

1993 ◽  
Vol 97 (15) ◽  
pp. 3765-3774 ◽  
Author(s):  
Ralf Akesson ◽  
Lars G. M. Pettersson ◽  
Magnus Sandstroem ◽  
Per E. M. Siegbahn ◽  
Ulf Wahlgren

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