Search results for "ddc:540"

Relaxation and charge transport in mixtures of zwitterionic polymers and inorganic salts

2009

Dielectric spectroscopy is employed to analyze the molecular dynamics and the charge transport in mixtures of zwitterionic polymers of the type poly(3-[N-(omega-methacryloyloxyalkyl)-N, N-dimethylammonio]propanesulfonate) with sodium iodide in the frequency range of 10(2) Hz-10(7) Hz and in the temperature range of 110 K-400 K. The amount of inorganic salt added varies from 0-200 mol-% relative to the number of zwitterionic groups present in the polymer, contributing strongly to the conductivity. One relaxation process is observed whose relaxation rate depends strongly on the length of the aliphatic spacer between the polymethacrylate main chain and the zwitterionic group. Exhibiting an Arr…

Efficient size control of copper nanoparticles generated in irradiated aqueous solutions of star-shaped polyelectrolyte containers

2015

Physical chemistry, chemical physics 17(17), 11490-11498(2015). doi:10.1039/C5CP00269A

Five-Membered 2-Methylene-2,3-dihydro Heterocycles from Ruthenium Butatrienylidene Intermediates and 2-(Dimethylamino)methyl-Substituted Furans, Thio…

2003

Trapping of the primary butatrienylidene intermediate trans-[Cl(dppm) 2 Ru=C=C=C=CH 2 ] + with five-membered 2-(dimethylamino)methyl-substituted heterocycles provides an easy and efficient route to aminoallenylidene complexes with appended 2-methylene-2,3-dihydrofuran, -thiophene, or -selenophene moieties. Upon warming or acid catalysis isomerization to the aromatic 2-methylated isomers is observed.

Characterization of the atmospheric muon flux in IceCube

2015

Muons produced in atmospheric cosmic ray showers account for the by far dominant part of the event yield in large-volume underground particle detectors. The IceCube detector, with an instrumented volume of about a cubic kilometer, has the potential to conduct unique investigations on atmospheric muons by exploiting the large collection area and the possibility to track particles over a long distance. Through detailed reconstruction of energy deposition along the tracks, the characteristics of muon bundles can be quantified, and individual particles of exceptionally high energy identified. The data can then be used to constrain the cosmic ray primary flux and the contribution to atmospheric …

Prediction of new inorganic molecules with quantum chemical methods

2006

Quantum chemistry can today be employed to invent new molecules and explore unknown molecular bonding. An overview of novel species containing metals bound to polynitrogen clusters is presented. The prediction of metal polyhydrides is discussed. Finally, some species containing gold that behaves as a halogen are described, together with recent advances in actinide chemistry and exploration of the nature of the actinide–actinide chemical bonding.

Quantum Chemical Calculations Predict the Diphenyl Diuranium Compound [PhUUPh] To Have a Stable1Ag Ground State

2006

Study of the MAu6(M = Cr, Mo, W) molecular species: A transition from halogenlike to hydrogenlike chemical behavior for gold

2004

Quantum chemical calculations suggest that a series of molecules with the general formula MAu6 are stable, where M is a a group 6 atom, Cr, Mo, W, respectively. These species have a structure analogous to the corresponding MH6 compounds, while they differ from the MX6, where X is a halogen. The further reaction MAu6 + 3Au2 → MAu12 is strongly exothermic.

Metal-Polyhydride Molecules Are Compact Inside a Fullerene Cage.

2015

Quantum chemical calculations show that metal−hydride molecules are more compact when they are placed inside a fullerene cage than when they are isolated molecules. The metal−hydrogen bond distance in ZrH4 becomes 0.15 A shorter when it is placed inside a C60 cage. Metal−polyhydride molecules with a large number of H atoms such as ScH15 and ZrH16, which are not bound as isolated molecules, are predicted to be bound inside a fullerene cage. It is also shown that two TiH16 clusters are bound inside a bicapped (9,0) carbon nanotube. Possible ways to make metal−hydrides inside C60 and nanotubes are suggested.

A theoretical study of the gas-phase chemi-ionization reaction between uranium and oxygen atoms

2005

The U+O chemi-ionization reaction has been investigated by quantum chemical methods. Potential-energy curves have been calculated for several electronic states of UO and UO+. Comparison with the available spectroscopic and thermodynamic values for these species is reported and a mechanism for the chemi-ionization reaction U+O -> UO++e(-) is proposed. The U+O and Sm+O chemi-ionization reactions are the first two metal-plus-oxidant chemi-ionization reactions to be studied theoretically in this way.

A search for new physics in dijet mass and angular distributions in pp collisions at [subscript √s=7] TeV measured with the ATLAS detector

2011

A search for new interactions and resonances produced in LHC proton–proton (pp) collisions at a centre-of-mass energy ps = 7 TeV was performed with the ATLAS detector. Using a dataset with an integrated luminosity of 36 pb−1, dijet mass and angular distributions were measured up to dijet masses of 3.5 TeV and were found to be in good agreement with Standard Model predictions. This analysis sets limits at 95% CL on various models for new physics: an excited quark is excluded for mass between 0.60 and 2.64 TeV, an axigluon hypothesis is excluded for axigluon masses between 0.60 and 2.10 TeV and quantum black holes are excluded in models with six extra space–time dimensions for quantum gravity…