✦ LIBER ✦

Isolated and embedded cluster modelling of the oxygen vacancy in α-quartz

✍ Scribed by V.B. Sulimov; C. Pisani; F. Corà; V.O. Sokolov

Publisher: Elsevier Science
Year: 1994
Tongue: English
Weight: 324 KB
Volume: 90
Category: Article
ISSN: 0038-1098
DOI: 10.1016/0038-1098(94)90056-6

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Cyclic cluster calculation on the electr

Cyclic cluster calculation on the electronic structure of α-quartz and of its vacancy

✍ P. Deák; J. Giber 📂 Article 📅 1982 🏛 Elsevier Science 🌐 English ⚖ 363 KB

Density Functional Embedded Cluster Stud

Density Functional Embedded Cluster Study of Cu4, Ag4 and Au4 Species Interacting with Oxygen Vacancies on the MgO(001) Surface

✍ Konstantin M. Neyman; Chan Inntam; Lyudmila V. Moskaleva; Notker Rösch 📂 Article 📅 2006 🏛 John Wiley and Sons 🌐 English ⚖ 270 KB 👁 2 views

Basis for large differences in the coope

Basis for large differences in the cooperativity of the formation of antiparallel β-sheets and clusters of interacting α-helices in isolated chains

✍ Wayne L. Mattice; Luanne Tilstra 📂 Article 📅 1987 🏛 Wiley (John Wiley & Sons) 🌐 English ⚖ 479 KB 👁 1 views

## Synopsis Configuration partition functions that describe the intramolecular formation of antiparallel /?-sheets and clusters of antiparallel interacting a-helices are very nearly of the same form. They can be interconverted by a simple change in notation and the addition of one weighting factor

The kinetics of molecular oxygen migrati

The kinetics of molecular oxygen migration in the isolated α chains of human hemoglobin as revealed by molecular dynamics simulations and laser kinetic spectroscopy

✍ Sergei V. Lepeshkevich; Sergey A. Biziuk; Alexander M. Lemeza; Boris M. Dzhagaro 📂 Article 📅 2011 🏛 Elsevier Science 🌐 English ⚖ 948 KB

The model of nucleation of vacancy clust

The model of nucleation of vacancy clusters in the cascade range in the stage of the thermal spike: V G Kapinos and P A Platonov, Radiat Effects, 103, 1987, 45–57

📂 Article 📅 1989 🏛 Elsevier Science 🌐 English ⚖ 146 KB

Shape resonance energies in the Xα scatt

Shape resonance energies in the Xα scattered-wave cluster model. A study of CO and N2 adsorbed on Ni surfaces

✍ A. Schichl; D. Menzel; N. Rōsch 📂 Article 📅 1984 🏛 Elsevier Science 🌐 English ⚖ 464 KB

XO~ scattered-wave calculations have been performed to compare the photon energy dependence of rhe valence level photoionization CIOSS sections of molecular CO and N2 and of Ni clusters simulatmg the adsorption of these molecules in the range of the shape resonances. Care has to be taken to avoid mu