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This report describes the aqueous solution self-assembly of a series of polystyrenem-b-poly(L-lysine)n block copolymers (m = 8-10; n = 10-70). The polymers are prepared by ring-opening polymerization of e-benzyloxycarbonyl-L-lysine AT-carboxyanhydride usin ...
We determine the fraction f of B atoms belonging to boroxol rings in vitreous boron oxide through a first-principles analysis. After generating a model structure of vitreous B2O3 by first-principles molecular dynamics, we address a large set of properties, ...
The excitation spectrum of a model magnetic system, LiHoF4, was studied with the use of neutron spectroscopy as the system was tuned to its quantum critical point by an applied magnetic field. The electronic mode softening expected for a quantum phase tran ...
We describe a scheme for calculating the infrared and Raman spectra of large model structures from first principles. Our scheme is based on the application of a finite electric field in density functional calculations with periodic boundary conditions. Cou ...
We discuss computationally efficient ways of accounting for the impact of uncertainty, e.g., lack of detailed knowledge about sources, materials, shapes etc, in computational time-domain electromagnetics. In contrast to classic statistical Monte Carlo base ...
Neutron scattering studies on powder and single crystals have provided new evidence for unconventional magnetism in Cu2Te2O5Cl2. The compound is built from tetrahedral clusters of S=1/2 Cu2+ spins located on a tetragonal lattice. Magnetic ordering, emergin ...
We discuss computationally efficient ways of accounting for the impact of uncertainty, e.g., lack of detailed knowledge about sources, materials, shapes etc, in computational time-domain electromagnetics. In contrast to classic statistical Monte Carlo base ...
In this study, we present a radiative-transfer model to simulate reflectance and transmittance of light by soil slabs. The radiative-transfer model implemented, referred to as the beam-tracing model, uses cross-sectional images of scattering media to descr ...
Inelastic neutron scattering, susceptibility, and high-field magnetization identify LiCuVO4 as a nearest-neighbour ferromagnetic, next-nearest-neighbour frustrated, quasi-one-dimensional helimagnet, which is largely influenced by quantum fluctuations. Comp ...
JET's recent experimental programme proved that 'burning plasma diagnostics', i.e. neutron, alpha particle, He ash, and fuel mixture measurements, can provide very useful information about crucial physical aspects of great reactor relevance. First of all, ...