The speed of digital circuit is one of the most restricting factors in the deep sub-micron and multigigahertz integrated circuits design. It is directly dependent on the circuit delay. Scaling down the technologies and increasing the operational frequency make the delay problems more important. This paper studies the delay in digital circuits, starting from the design process, scaling down the ...

Solid-state NMR and DFT calculation studies certified the presence of an intermolecular solvent effect for molecules confined in microporous zeolite, leading to a notable increase in Brønsted acidity of the solid acid catalyst.

We propose a model potential for computing total ionization cross sections atoms and molecules by electron impact. The is obtained fitting procedure using the Binary–Encounter–Bethe as starting point. present section hydrogen, carbon, nitrogen oxygen nitrogen, water, methane benzene molecules. results with our are compared first Born approximation, agreement quite good. Our show that this could...

Molecular dynamics (MD) simulations complement experimental methods in studies of the structure and dynamics of lipid bilayers. The choice of algorithms employed in this computational method represents a trade-off between the accuracy and real calculation time. The largest portion of the simulation time is devoted to calculation of long-range electrostatic interactions. To speed-up evaluation o...

In chemistry it has been a long established practice to represent molecules by graphs, with the constituent atoms and the interconnecting bonds taking the roles of vertices and edges, respectively. Whereas such representations contain a great amount of chemical information, and are of considerable value, nonetheless, they are in general insufficient to account for energy differences between var...

We show that weakly bound He-containing van der Waals molecules can be produced and magnetically trapped in buffer-gas cooling experiments, and provide a general model for the formation and dynamics of these molecules. Our analysis shows that, at typical experimental parameters, thermodynamics favors the formation of van der Waals complexes composed of a helium atom bound to most open-shell ato...

to get a mole of a gas, it is necessary to calculate the intermolecular interaction. theseintermolecular interactions can be depicted by drawing the potential energy of a pair molecule inrelation to the distance. the intermolecular potential energy surface in the mixtures of ch4-h2cogases from ab initio calculations has been explored. in ab initio calculations the basis setsuperposition error (...

platelet activation and adhesion to the site of vascular injury is a dynamic process comprising reversible and irreversible phases. platelet adhesion typically occurs in a multi-step process similar to the selectin/integrin-mediated adhesion of neutrophils. this phenomenon is highly regulated and influenced by the cross-talk between platelets and injured endothelium. this cross-talk involves a ...