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HCR BADL and IADL subscales associated with perceived environmental barriers were calculated with a multinomial logistic regression, using the total CHIEF-CET score and its four subscales as dichotomous dependent variables.
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As with all other energy barriers calculated in this work, energy barriers were calculated as the difference in energy between the transition state and reactant complex.
Adsorption energies and barriers are calculated and discussed.
For small to medium-sized polymer systems, theoretical reaction barriers are calculated using G3(MP2 -RAD.
The number of barriers was calculated using the I&I NSW database (I&I NSW, 2008).
Hydrogen bonds were calculated with HBPLUS [19].
Intensities were calculated with Graph Pad Prism.
Positions were calculated with software BirdTracker (BAS).
Dot-matrices were calculated with Biopython [37].
In this paper, the valence electron densities ρh k l and ρuvw of the two sides and their difference Δρmin of the bonding layer/ceramic layer interface of thermal barrier coatings are calculated with the empirical electron theory in solids and molecules at various bonding layer yttrium content.
Thus, criterion weights (priority) are calculated with respect to the goal, and barrier weights are computed with respect to each of the criterion.
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