Sentence examples for cluster model of from inspiring English sources

The results were analysed within the framework of the cluster model of structure of the polymer amorphous state.

His cluster model of the atomic nucleus was rejected by physicists, his interpretation of the newly discovered quasicrystals received little support, and his ideas on vitamin C were rejected by the medical establishment.

Two HEAs with a composition of Al2M14 (M = Ni4Co4Fe3Cr3 or Ni1Co1Fe2Cr1) are designed, which is derived from the cluster model of [Al-M12](M2Al1) in face-centered-cubic structure or [Al-M14]Al1 in body-centered-cubic structure.

Furthermore, the thermodynamic fragility index ΔSf/(Tm − TK) was reduced to ΔSf/Tm assuming TK ≈ Tm/2, and the correlation between ΔSf/Tm and kinetic fragility was discussed within the context of recently proposed cluster model of the glass transition.

The adsorption structures for maleic anhydride, succinic anhydride, γ-butyrolactone, THF, water and atomic hydrogen were completely optimized on a fixed Pd(12,7) cluster model of the Pd(1 1 1) surface.

Recent results from the MDI instrument on SOHO reveal complicated stratification and flow patterns of solar plasma beneath sunspots, with a characteristic temperature increase in deeper layers and multiple vortex systems, providing evidence for a cluster model of sunspots.

Stoichiometric cluster models of the oxide substrate were designed, employing bare pseudopotential cations located at the cluster boundaries.

In the present work, we used a QM/MM and a QM cluster models of TAL to explore two putative reaction paths for its catalytic mechanism.

These studies have been based on the use of ab initio electronic wavefunctions for cluster models of the adsorbate substrate system.

The goal of this study is creation of cluster models of ANP of size below 2.5 nm and checking the applicability of modern semiempirical methods PM6 and PM7 for their description.

We have carried out calculations of the electronic structure of ferredoxin and of the electronic coupling matrix element Hif for electron transfer from reduced ferredoxin to flavin adenine dinucleotide (FAD) and to cluster models of the Au111 surface and a Au111 surface with a mercaptopyridene self-assembled monolayer (SAM).