Graphene layer growth: Collision of migrating five-member rings

A reaction pathway is explored in which two cyclopenta groups combine on the zigzag edge of a graphene layer. The process is initiated by H addition to a five-membered ring, followed by opening of that ring and the formation of a six-membered ring adjacent to another five-membered ring. The elementary steps of the migration pathway are analyzed using density functional theory to examine the region of the potential energy surface associated with the pathway. The calculations are performed on a substrate modeled by the zigzag edge of tetracene. Based on the obtained energetics, the dynamics of the system are analyzed by solving the energy transfer master equations. The results indicate energetic and reaction-rate similarity between the cyclopenta combination and migration reactions. Also examined in the present study are desorption rates of migrating cyclopenta rings which are found to be comparable to cyclopenta ring migration.     

Combining magnetic resonance measurements with numerical simulations – Extracting blood flow physiology information relevant to the investigation of intracranial aneurysms in the circle of Willis

Cerebral aneurysms in the region of the circle of Willis have an incidence of 3–6% in western populations and involve the risk of rupture with subsequent subarachnoidal bleeding. The patient specific blood flow patterns are of substantial importance for understanding the pathogenesis of the lesions and may eventually contribute to deciding on the most efficient treatment procedure for a specific patient.A non-invasive method for performing in vivo measurements on blood velocity is 4D phase-contrast magnetic resonance angiography (PC-MRA), on the basis of which a flow field with all its parameters can be simulated. We are using this approach to investigate the hemodynamic parameters in the circle of Willis and, by analyzing the values at common locations of aneurysms, trying to find potential parameters to predict the development of aneurysms. Methodologically, we are acquiring the artery geometry with 3D-time-of-flight magnetic resonance (TOF) measurements and the blood velocity in the feeding arteries with 4D PC-MRA measurements in a healthy volunteer. These measurements are combined with computational fluid dynamics (CFD) to describe detailed hemodynamic patterns within the circle of Willis.     

Light scattering from albumins

In light scattering data of albumins, one distinguishes a large broad band from the normal Raman lines. That broad band in ovuline albumin is shown to have a pseudo-Raman behavior.     

Resolved pseudo-raman spectrum of ovuline albumin

A series of resolved pseudo-Raman peaks, in harmonic position, is obtained from ovuline albumin. The spectrum is a function of the water layer bonded to the molecule. Data are in agreement with the theory of “electromagnetic molecular electronic resonance”.