Sökning: "density"
Visar resultat 6 - 10 av 4588 avhandlingar innehållade ordet density.
6. Manganese and Iron Heterodimers and Homodimers in Enzymes : Insights from Density Functional Theory
Sammanfattning : The enzyme ribonucleotide reductase (RNR) catalyzes the reduction of ribonucleotides to deoxyribonucleotides, the building blocks of DNA, and is essential for all organisms. Canonical class I RNR R2 proteins use a diiron cofactor to generate a tyrosyl radical, which is required for catalysis. LÄS MER
7. Processing Methods for Reaching Full Density Powder Metallurgical Materials
Sammanfattning : Powder metallurgy (PM) is one of the most cost effective methods for manufacturing structural components with complex shapes. Utilisation of the metal powder to shape the components allows to minimise material waste and increase energy efficiency. LÄS MER
8. Applied density functional theory : calculating structures and energies on ribonucleotide reductase and polycyclic aromatic hydrocarbons
Sammanfattning : .... LÄS MER
9. Cluster investigations of the extent and altitude distribution of the auroral density cavity
Sammanfattning : The auroral density cavity constitutes the boundary between the cold, dense ionospheric plasma and the hot, tenuous plasma sheet plasma. The auroral density cavity is characterized by low electron density and particle populations modified by parallel electric fields. LÄS MER
10. Nonlocal Correlations in Density Functional Theory
Sammanfattning : In Density Functional Theory, the widely used local and semilocal approximations to the exchange-correlation energy, the local density approximation (LDA) and the generalized gradient approximations (GGAs), lack a physical description of truly nonlocal correlation effects, which are absolutely essential for a proper description of soft matter. A scheme is proposed that provides a basis for systematic improvements beyond LDA and GGA, including correlations at intermediate and long range, giving rise to bonds of pure van der Waals type as well as more intricate, intermediate-range correlation bonds. LÄS MER