Search results for " Alloys"
showing 10 items of 1469 documents
Oligo(phenylenevinylene)s with reactive side chains: amine- and amide-bound alkoxysilanes
2002
Strongly luminescent oligo(phenylenevinylene) chromophores with monodisperse chain lengths are connected via short spacers containing a secondary amine or amide with di- and tri-ethoxysilane groups. The alkoxysilanes can be hydrolysed and condensed to cyclic and linear oligomers with high film forming capability and are also interesting functional units for hybrid materials for electro-optical applications. The luminescence properties in the solid state are influenced by hydrogen bonding of the amides resulting in strong hypsochromic shifts. The synthesis of the title compounds, their oligomerisation and the electronic spectra in the solution and solid state are presented.
Tuning of the photoinduced charge transfer process in donor-acceptor "double cable" copolymers
2003
The covalent linking of acceptor molecules to electron donating conjugated polymer is an approach for the development of new photoactive materials for the fabrication of organic photoelectric conversion devices. With this strategy we have designed a polyalkylthiophene copolymer series containing in the side chain anthraquinone molecules as electron acceptor. The peculiar features of the copolymers are the good processability and the ease in tailoring the content of acceptor moieties. Their potential use as photoactive materials is investigated in terms of the photoinduced charge transfer properties, studied by FTIR photoinduced absorption and Light Induced Electron Spin Resonance spectrosco…
Asymmetrical tunneling in heavy fermion metals as a possible probe for their non-Fermi liquid peculiarities
2007
Tunneling conductivity and point contact spectroscopy between heavy fermion metal and a simple metallic point contact may serve as a convenient probing tool for non-Fermi liquid behavior. Landau Fermi liquid theory predicts that the differential conductivity is a symmetric function of voltage bias. This symmetry, in fact, holds if so called particle–hole symmetry is preserved. Here, we show that the situation can be different when one of the two metals is a heavy fermion one whose electronic system is a heavy fermion liquid. When the heavy fermion liquid undergoes fermion condensation quantum phase transition, the particle–hole symmetry in the excitation spectra is violated making both the …
Calculations of the atomic and electronic structure for SrTiO3 perovskite thin films
2001
The results of calculations of SrTiO3 (100) surface relaxation and rumpling with two different terminations (SrO and TiO2) are presented and discussed. We have used the ab initio Hartree–Fock (HF) method with electron correlation corrections and the density functional theory (DFT) with different exchange–correlation functionals, including hybrid exchange techniques. All methods agree well on surface energies and on atomic displacements, as well as on the considerable increase of covalency effects near the surface. More detailed experiments on surface rumpling and relaxation are necessary for further testing of theoretical predictions.
Quantum Monte Carlo study of insulating state in NaV2O5
2003
Abstract Quantum Monte Carlo (QMC) methods are being increasingly used as complements to Hartree–Fock (HF) methods for computing the electronic structure of molecules and materials. We investigate the nature of the insulating state driven by electronic correlations in the ladder compound NaV 2 O 5 ; considered as a quarter-filled system. We use an extended Hubbard model (EHM) to study the role of on-site and inter-site Coulomb interaction. It is found that the insulating state in the charge-disordered phase of this compound take origin from the transfer of spectral density and dynamical fluctuations. Our calculation allows us also, to understand the origin of the insulating states above T C…
Crystal field effects and magnetic properties of Dy2Te3
1995
Abstract Magnetic susceptibility and magnetization measurements are presented for Dy 2 Te 3 . By means of crystal field calculations the energy levels of ground state and crystal field potentials for Dy 3+ ions have been evaluated taking the exchange interactions into account.
Domain wall splitting and creation of the fine domain structure
1998
Abstract The study of the movement of the paraelectric-ferroelectric interphase boundary in (Ba,Sr)TiO 3 with concentration change is provided in the framework of the mean-field theory. The analytical solution for the parameters of motion of the interphase boundary is applied to the calculations of the splitting of domain walls in (Ba,Sr)TiO 3 for different concentrations of Sr. The calculations are based on the experimental data for the Curie–Weiss constant and for the parameters of the Landau–Ginzburg expression for the free energy.
Comparative study of [001] surface relaxations of perovskite titanates
1998
Surface relaxations of the cubic perovskite SrTiO and BaTiO crystals have been studied in the framework of the shell model. The 33 positions of atoms in several surface layers embedded into the electrostatic field of the remainder of the crystal were calculated. Ti 4q , Sr 2q ,B a 2q and O 2y ions in six near-surface layers are displaced differently from their crystalline sites. Such effects create the so-called surface rumpling, a dipole moment and the electric field in the near-surface region. Calculated atomic displacements were compared with the LEED experimental data and showed good agreement. Our simulations have demonstrated that the cubic perovskite SrTiO crystals 3 reveal surface p…
A new BEDT-TTF salt and polypyrrole films containing the chiral polyoxometalate [H4Co2Mo10O38]6−
2005
Abstract The chiral polyoxometalate [H4Co2Mo10O38]6− has been used in the preparation of hybrid materials in the form of crystals or polymeric films. A new radical salt of the donor bis(ethylenedithio)tetrathiafulvalene (BEDT-TTF or ET) containing the two enantiomers of this polyoxometalate has been obtained by electrocrystallization. This radical salt shows semiconducting behavior with room temperature conductivity of 9 S.cm−1 and activation energy of 40 meV. Polypyrrole films doped with a racemic mixture of polyoxometalates and also the enantiomerically pure (+)589-[H4Co2Mo10O38]6− have been prepared electrochemically. Circular dichroism experiments suggest that the chiral polyoxometalate…
Hybrids composites of NCCO/PEDOT for thermoelectric applications
2017
Abstract Organic materials are becoming a realistic roadway to fabricate efficient thermoelectric devices using environmental friendly materials. Such requirements are actually fulfilled by thermoelectric generators operating by conducting polymers, but also by hybrid materials. The combination of organic + inorganic compounds may exhibit a high electrical conductivity and Seebeck coefficient as well as lower thermal conductivity in order to efficiently generate thermoelectric power. In these hybrid compounds, perovskite-type oxides are a suitable election for the inorganic part since they have a high Seebeck coefficient although their electrical conductivity is usually low. Blending them w…