Sentence examples for local softness from inspiring English sources
The molecular weights calculated from comparative molecular field analysis (CoMFA) models including LUMO and local softness fields correlate well with the experimental ones.
Our results provide useful correlations between experimental ethylene polymerisation activities and the steric, LUMO and local softness fields of the catalysts.
Specifically, we explore application of the Fukui function, the global hardness and softness, the local softness, and the dual descriptor to pure metallic and core shell nanoparticles, with and without a CO molecule bound to the surface.
Local softness σ* for the inhibitor molecule that acts as the nucleophile is given by Klopman [65]: sigma^, =,sigma rho_{{_{text{HOMO}} }}where ρ HOMO is a normalized electron density of the frontier orbital.
This technique has been found to be successful in providing insights into the chemical reactivity and selectivity in terms of global parameters such as electro-negativity (v), hardness (g) and softness (S), and local softness (sđ~r Þ) [44, 45].
Since First Fidelity was created in 1988 in a merger of banking companies in Newark and Philadelphia, it has been plagued by softness in its local economy and falling real estate prices.
But the forecaster, Robert J. Coen, reduced his prediction for ad spending growth in local media across the country, citing softness in categories like retail and classifieds.
Global and local descriptors such as molecular hardness, softness and electrophilicity, and condensed Fukui functions and local philicity indices were used to understand the mechanistic aspects of chemical reaction.
For the simplest transfer of electrons, adsorption should occur at the part of the molecule where the softness, σ, which is a local property, has the highest value.
Soft touchable hair that moves adds softness to your face.
This interpretation is consistent with our recent findings in embryonic stem cells and differentiated cells that cell softness dictates biological responses of a living cell to a local stress [17].
