排序方式: 共有34条查询结果,搜索用时 0 毫秒
1.
Stanislav S. Stoyko Andrew J. Craig Joshua W. Kotchey Jennifer A. Aitken 《Acta Crystallographica. Section C, Structural Chemistry》2021,77(1):1-10
The new quaternary thiosilicate, Li2PbSiS4 (dilithium lead silicon tetrasulfide), was prepared in an evacuated fused‐silica tube via high‐temperature, solid‐state synthesis at 800 °C, followed by slow cooling. The crystal structure was solved and refined using single‐crystal X‐ray diffraction data. By strict definition, the title compound crystallizes in the stannite structure type; however, this type of structure can also be described as a compressed chalcopyrite‐like structure. The Li+ cation lies on a crystallographic fourfold rotoinversion axis, while the Pb2+ and Si4+ cations reside at the intersection of the fourfold rotoinversion axis with a twofold axis and a mirror plane. The Li+ and Si4+ cations in this structure are tetrahedrally coordinated, while the larger Pb2+ cation adopts a distorted eight‐coordinate dodecahedral coordination. These units join together via corner‐ and edge‐sharing to create a dense, three‐dimensional structure. Powder X‐ray diffraction indicates that the title compound is the major phase of the reaction product. Electronic structure calculations, performed using the full potential linearized augmented plane wave method within density functional theory (DFT), indicate that Li2PbSiS4 is a semiconductor with an indirect bandgap of 2.22 eV, which compares well with the measured optical bandgap of 2.51 eV. The noncentrosymmetric crystal structure and relatively wide bandgap designate this compound to be of interest for IR nonlinear optics. 相似文献
2.
3.
In this paper we introduce a class of operators naturally extending the classes of hyponormal and posinormal operators. For this class we construct a generating family of eigendistributions, unitary invariants and a functional model. 相似文献
4.
S. Fakirov Z. Sarac T. Anbar B. Boz I. Bahar M. Evstatiev A. A. Apostolov J. E. Mark A. Kloczkowski 《Colloid and polymer science》1997,275(4):307-314
This second part of a systematic study of the properties of crosslinked-oriented gelatin involves the effects of orientation
and water content on the glass transition temperature T
g and on the melting behavior. The samples were the same as those in the preceding study, and their transition temperatures
were determined by both differential scanning calorimetry and dynamic mechanical thermal analysis. The crosslinked gelatin
which had been room-conditioned showed two transition temperatures: the lower one was attributed to T
g of the water-plasticized gelatin, and the higher one was interpreted as T
g of dried gelatin superimposed by melting. A rather unusual situation arose because of the fact that the T
g and melting temperatures T
m (217 and 230 °C, respectively) are so similar. Using water as plasticizer not only decreases T
g but produces imperfect crystallites which melt below the T
g of the system. The presence of the amorphous phase in the glassy state would presumably make it essentially impossible to
define a melting point or crystallization temperature in the normal manner, as an equilibrium between crystalline and amorphous
phases.
Received: 8 October 1996 Accepted: 2 November 1995 相似文献
5.
6.
Stanislav S. Stoyko 《Journal of solid state chemistry》2011,184(9):2360-11161
The ternary rare-earth zinc arsenides REZn1−xAs2 (RE=La-Nd, Sm) were prepared by reaction of the elements at 800 °C. Single-crystal and powder X-ray diffraction analysis revealed a defect SrZnBi2-type average structure for the La member (Pearson symbol tI16, space group I4/mmm, Z=4; a=4.0770(9) Å, c=20.533(5) Å), in contrast to defect HfCuSi2-type average structures for the remaining RE members (Pearson symbol tP8, space group P4/nmm, Z=2; a=4.0298(5)-3.9520(4) Å, c=10.222(1)-10.099(1) Å in the progression from Ce to Sm). The homogeneity range is not appreciable (estimated to be narrower than 0.6<1−x<0.7 in SmZn1−xAs2) and the formula REZn0.67As2 likely represents the Zn-rich phase boundary. The Ce-Nd members are Curie-Weiss paramagnets. LaZn0.67As2 shows activated behavior in its electrical resistivity, whereas SmZn0.67As2 exhibits anomalies in its temperature dependence of the electrical resistivity. 相似文献
7.
Considering the well‐known phenomenon of multimelting peak of crystalline polymers, it has been demonstrated that for calculating the degree of crystallinity using the heat of fusion, all the melting peaks observed have to be accounted for regardless of their origin‐recrystallization or presence of different crystalline modifications. 相似文献
8.
Stoyko Gyurov Diana Rabadjieva Daniela Kovacheva Yoanna Kostova 《Journal of Thermal Analysis and Calorimetry》2014,116(2):945-953
The kinetics of air copper slag oxidation under nonisothermal conditions is studied using simultaneous TG–DTA at a varying heating rate of slag and flow rate of the oxidizing gas flux. The values of the kinetic parameters, activation energy and pre-exponential factor, have been determined based on: data from DTA by the methods of Kissinger and Ozawa; data from TG using an isoconversion method and the computation procedures of Ozawa–Flynn–Wall and Kissinger–Akahira–Sunose. No relationship between the kinetic parameters and the oxidation gas flow rate has been established. The changes of the phase composition with temperature are investigated by X-ray powder diffraction analysis on the basis of data obtained for the products formed at the different stages of the oxidation process. The morphology of the oxidized slag as well as the elements distribution is studied by electron microscopy and EDS analysis. 相似文献
9.
S. Fakirov F. J. Balt Calleja M. Krumova 《Journal of Polymer Science.Polymer Physics》1999,37(13):1413-1419
On the basis of microhardness (H) data measured at room temperature only for a number of polymers in the glassy state, a linear correlation between H and the glass transition temperature Tg has been found (H = 1.97Tg − 571). By means of this relationship, the deviation of the H values from the additivity law for some multicomponent and/or multiphase polymeric systems can be accounted for. The latter usually contains a liquidlike soft component and/or phase with Tg below room temperature. A completely different deformation mechanism in comparison to systems with Tg above room temperature is invoked. A novel expression for the hardness of polymers in terms of crystallinity of the single components and/or phases, the Tg values, and the mass fraction of each component is proposed. This expression permits the calculation of (i) the room‐temperature H value of amorphous polymers, mainly containing single bonds in the main chain, provided Tg is known, and of (ii) the contribution of the soft liquidlike components (phases) to the hardness of the entire multiphase system. © 1999 John Wiley & Sons, Inc. J Polym Sci B: Polym Phys 37: 1413–1419, 1999 相似文献
10.
S. Fakirov 《Journal of Polymer Science.Polymer Physics》1984,22(12):2095-2104
A new molecular mechanism for the healing phenomenon in semicrystalline linear polycondensates (healing resulting from chemical reactions between macromolecules located in the interfacial surface) is demonstrated. Strips of commercial poly(ethylene terephthalate) are annealed at 258°C in order to avoid melt sticking. Two such strips are partially overlapped, pressed, and heated in a vacuum at 240°C for 10, 20, 30, and 100 h. By measuring the stress at break outside the contact area and the debonding shear stress the critical overlapping length is computed. It is concluded that transreaction contributes more than solid-state post-condensation to chemical healing. 相似文献