Sentence examples for located energetically from inspiring English sources

As the d-state of Cu+ and the valence band of the CdS QDs are located energetically nearby, the hole could be transferred to the Cu+ d-state, changing Cu+ into Cu2+, which then participates in radiative recombination with an electron [26, 27].

Both isomers 2 and 3 are connected by the transition structure TS 2/ 3, which is located energetically just below the entrance channel of the separated reactants.

Our augmented bond valence approach may be used to establish structure property relationships in solid electrolytes, to identify the mobile species and to locate energetically favorable transport pathways for the mobile type of ions through the bond valence sum mismatch "landscape" created by the immobile substructure.

The special feature of Q-SiteFinder is that it uses interaction energy and a simple van der Walls probe to locate energetically favourable binding sites.

The presence of binding sites was also cross-checked using Q-SiteFinder [ 31], which uses the interaction energy between the protein and a simple van der Waals probe to locate energetically favorable binding sites.

Thermodynamic calculations located an energetically favored composition region for metallic glass formation, and also characterized the composition dependence of the glass-forming ability.

We find that two sub-bands are energetically located above the Fermi level in the InAs middle shell belonging to the m = 0 and m = 1 ladder of angular momentum states which have similar wave functions and energies.

In contrast, the lowest m = 0 sub-band in the core is energetically located 5 meV above the Fermi level and falls to 40 meV below the Fermi level upon increasing the core radius from 10 to 40 nm.

The residual emission at 600 nm is attributed to radiative recombination via states that are energetically located within the energy band gap and which are related to structural defects and surface states [2 4].

While the Langmuir theory assumes that the adsorption is located on identical and energetically homogeneous and equivalent sites, the Freundlich theory treats about heterogeneous nature of adsorbent surface.

The docked poses generated from docking into this mutant also had a significantly increased RMSD variation compared to wild type, suggesting that the ginkgolides were located in a less energetically favorable position.