Search results for "COPP"
showing 10 items of 3147 documents
Phase transition of tetragonal copper sulfide Cu2S at low temperatures
2017
The low-temperature behavior of tetragonal copper sulfide, ${\mathrm{Cu}}_{2}\mathrm{S}$, was investigated by powder and single-crystal x-ray diffraction, calorimetry, electrical resistance measurements, and ambient temperature optical absorption spectroscopy. The experiments were complemented by density-functional-theory-based calculations. High-quality, polycrystalline samples and single crystals of tetragonal copper sulfide were synthesized at 5 GPa and 700 K in a large volume multianvil press. Tetragonal ${\mathrm{Cu}}_{2}\mathrm{S}$ undergoes a temperature-induced phase transition to an orthorhombic structure at around 202 K with a hysteresis of $\ifmmode\pm\else\textpm\fi{}21$ K, an e…
Mobilization upon Cooling
2021
Abstract Phase transitions between different aggregate states are omnipresent in nature and technology. Conventionally, a crystalline phase melts upon heating as we use ice to cool a drink. Already in 1903, Gustav Tammann speculated about the opposite process, namely melting upon cooling. So far, evidence for such “inverse” transitions in real materials is rare and limited to few systems or extreme conditions. Here, we demonstrate an inverse phase transition for molecules adsorbed on a surface. Molybdenum tetraacetate on copper(111) forms an ordered structure at room temperature, which dissolves upon cooling. This transition is mediated by molecules becoming mobile, i.e., by mobilization up…
Study of the spontaneous relaxor to normal ferroelectric phase transition in la-doped lead titanate
2000
Abstract Highly lanthanum doped lead titanate ceramics exhibit relaxor properties and undergo on cooling a subsequent spontaneous macroscopic phase transition. The dielectric response is strongly affected by chemical (copper) doping and is found to become independent of the applied ac field for temperatures lower than the phase transition one.
Structural evolution of theCuGaO2delafossite under high pressure
2004
We have performed pseudopotential calculations and x-ray-diffraction and x-ray-absorption measurements on the ${\mathrm{CuGaO}}_{2}$ delafossite under high pressure. We have completely characterized the structural behavior of the low pressure phase. We have found out that the a axis is more compressible than the c axis, and as a consequence the oxygen octahedra defined by the gallium environment tend to become more regular under high pressure. We have determined the internal parameter describing the oxygen position inside the unit cell, and seen that it is nearly constant when pressure is applied. We have observed an irreversible phase transition affecting the copper environment but not the…
Spatial inhomogeneities and defect structures in CIGS and CIS materials: An ab-initio based Monte Carlo study
2011
The chalcopyrite semiconductors CuIn 1−x Ga x Se 2 (CIGS) and CuInSe 2 (CIS) are excellent materials for high efficiency and low cost thin-film solar cells. This is due to the effective absorption of the solar spectrum and the inherent resilience to defects and composition fluctuations. Although the CIGS and CIS material in solar cells is highly inhomogeneous and exhibits a lot of different defects, the cell efficiencies are exceptionally high. If single crystalline absorbers are used, efficiencies are lower. Therefore, studying spatial inhomogeneities and defect structures is of great importance for understanding what supports and what diminishes the efficiency and robustness of the cells.…
Multitechnique Analysis of the Hydration in Three Different Copper Paddle-Wheel Metal-Organic Frameworks
2019
The structural instability in a humid environment of the majority of metal-organic frameworks (MOFs) is a challenging obstacle for their industrial-scale development. Recently, two water-resistant MOFs have been synthetized, STAM-1 and STAM-17-OEt. They both contain copper paddle wheels, like the well-known water-sensitive HKUST-1, but different organic linkers. The crystal lattice of both the MOFs undergoes a phase transition upon interaction with water molecules. Their unusual flexibility allows the controlled breaking of some interpaddle wheel Cu-O interactions in the so-called crumple zones, with a mechanism called hemilability, which is considered to have a crucial role for the stabili…
Pressure effect on the magnetism of layered copper(II) compounds with interlayer spacing up to 40.7 Å: Nature of the magnetic ordering
2002
The influence of pressure on the structure and magnetic properties of the layered hybrid compounds Cu 2 (OH) 3 (n-C m H 2 m + 1 CO 2 ), zH 2 O is investigated for m = 10 and 12. It is shown that the distance between magnetic copper(II) layers, up to 40.7 A, is not significantly modified and that the temperature of the ferromagnetic ordering decreases linearly with pressure increase. We present a new analysis of the susceptibility data, based on the scaling theory of phase transitions, which clearly shows up a crossover from a high-temperature two-dimensional (2D) behavior to a 3D regime at about 30 K, around 10 K above the long-range ordering temperature. A model of quantum ferromagnetic la…
Thermoelectric Transport in Cu7PSe6 with High Copper Ionic Mobility
2014
Building on the good thermoelectric performances of binary superionic compounds like Cu2Se, Ag2Se and Cu2S, a better and more detailed understanding of phonon-liquid electron-crystal (PLEC) thermoelectric materials is desirable. In this work we present the thermoelectric transport properties of the compound Cu7PSe6 as the first representative of the class of argyrodite-type ion conducting thermoelectrics. With a huge variety of possible compositions and high ionic conductivity even at room temperature, the argyrodites represent a very good model system to study structure-property relationships for PLEC thermoelectric materials. We particularly highlight the extraordinary low thermal conduct…
Paleolimnological evidence of environmental changes in seven subtropical reservoirs based on metals, nutrients, and sedimentation rates
2021
Made available in DSpace on 2022-04-28T19:40:54Z (GMT). No. of bitstreams: 0 Previous issue date: 2021-11-01 Paleolimnological research can shed light on a broad range of environmental concerns; however, such studies are scarce in reservoirs. To address this lack of knowledge, a paleolimnological investigation was conducted to determine historical changes in sedimentation rates (SR), using 210Pb geochronology, and concentrations of nutrients and metals (Cr, Cu, Ni, Pb, Zn, Al, Mn, Fe) in seven subtropical reservoirs (São Paulo, Brazil). Sediment cores were collected in the dam areas. Increasing SR was observed in all reservoirs and was mainly attributed to eutrophication and changes in land…
Wide-Bite-Angle Diphosphine Ligands in Thermally Activated Delayed Fluorescent Copper(I) Complexes: Impact on the Performance of Electroluminescence …
2021
We report a series of seven cationic heteroleptic copper(I) complexes of the form [Cu(P^P)(dmphen)]BF4, where dmphen is 2,9-dimethyl-1,10-phenanthroline and P^P is a diphosphine chelate, in which the effect of the bite angle of the diphosphine ligand on the photophysical properties of the complexes was studied. Several of the complexes exhibit moderately high photoluminescence quantum yields in the solid state, with ΦPL of up to 35%, and in solution, with ΦPL of up to 98%. We were able to correlate the powder photoluminescence quantum yields with the % Vbur of the P^P ligand. The most emissive complexes were used to fabricate both organic light-emitting diodes and light-emitting electrochem…