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Section III gives calculated results for numerous scenarios.
We find that the self-consistent hybrid functional gives calculated properties with accuracies as good as or better than the PBE0 hybrid functional.
This gives calculated chemical formulas of Ca3.3Na2.1Si5.1Al1.1O16(OH)2 6.2H2O for Al-CSH and Ca4.3Na1.4Si5.3Al0.9O16(OH)2 4.9H2O for tobermorite, assuming that the O and OH compositions have ideal stoichiometry.
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In Section 2.6, this regression model will be used in forecasting gas prices given calculated and forecasted explanatory variables.
α 95 and k are reported as given in a publication or if not given, calculated from specimen or sample directions, following Fisher (1953).
The model equations give calculated expansions at 525 and 825 °C within a few 0.1 mm/m of the original measurement for most coatings.
We suspect that the main reason is that we have observed at least some species for which Helz et al. [24] do not give calculated Raman shifts.
Apol-IE gave calculated molecular mass of 61,694 Da, pI of 7.49, two potential N-glycosylation sites, and a putative active site with the sequence Gly214-Tyr-Ser-Ala-Gly.
In this paper, we have shown the second prototype design of the upper body of Archie, and we have discussed the dimensions giving calculated values of length of links, the weight and centre of weight of these links.
The concentration of free calcium was increased by incremental addition of CaCl2 to give calculated free Ca2+ concentrations, and additional emission spectra were measured as before.
In contrast, the observed dispersal parameters of flying individuals gave calculated fitness parameters far lower than the theoretical maximum.
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