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1.
By means of Mössbauer and X-ray structural investigation it was shown that the compounds Sn3S4 and Sn2S3 can be synthesized mechanochemically. The influence of an inert additive on the explosive character of the mechanochemical synthesis of tin sulfides was investigated. A transition from the explosive way of synthesis to the nonexplosive one upon adding great quantities of inert material was observed. A mechanism explaining this phenomenon was suggested. The initiation of a high-temperature synthesis reaction by the heat effect of a mechanochemical explosive reaction was observed for the first time. 相似文献
2.
MM. J. Duflos D. Letouz G. Queguiner P. Pastour 《Journal of heterocyclic chemistry》1973,10(6):1083-1084
This communication describes the synthesis of l-methyl-2,3-diformylpyrrole. This new compound is used to prepare a new heterocycle, l-methylcyclohepta[b]pyrrol-6-one and thus allows a new synthesis of l-methylpyrrolo[2,3-d]pyridazine. 相似文献
3.
Multicanonical (MUCA) sampling is a powerful approach for simulating large domains of thermodynamic macrostate space that relies on mapping out either the density of states or a free energy of the system as a function of a suitable "order parameter." The purpose of this study is to extend and apply to more complex systems the method introduced in a previous paper [M. K. Fenwick and F. A. Escobedo, J. Chem. Phys. 120, 3066 (2004)] that uses Bennett's acceptance ratio method for estimating MUCA free energies. Four types of MUCA schemes are considered according to what order parameter is adopted and how the macrostate space is traversed: a la grand canonical ensemble, a la semigrand canonical ensemble, a la semigrand isothermal-isobaric ensemble, and a la isothermal-isobaric ensemble. Two types of systems are studied, the first is a two-component Lennard-Jones mixture that exhibits a vapor-liquid transition, and the second is a hard-cuboid containing system that exhibits an isotropic-liquid crystalline transition. These systems are simulated with different MUCA schemes and the resulting free-energy profiles are used to determine phase-coexistence conditions. For the Lennard-Jones systems, it is also demonstrated that different types of MUCA simulations can be conveniently performed over different macrostate regions and the results can be subsequently pieced together into a continuous weighting function. 相似文献
4.
Summary The solubility of the system Tl2O3-SeO3-H2O was studied at 100°C. The compounds obtained were subjected to X-ray and thermal analysis. The symmetry and the crystallographic constants of some of the compounds were determined. 相似文献
5.
Summary The solubility isotherm of the system Tb2O3-SeO2-H2O at 100° was studied. The compounds of the three-component system were identified by the Schreinemakers’ method as well as by chemical and X-ray phase analyses. Simultaneous TG and DTA analyses of all compounds of the system were made. The mechanism of thermal decomposition was described. 相似文献
6.
Lyubomir T. Vlaev Maria M. Nikolova Georgy G. Gospodinov 《Monatshefte für Chemie / Chemical Monthly》2005,83(2):1553-1566
The dehydration kinetics of crystallohydrates of beryllium, magnesium and calcium selenites were studied under non-isothermal conditions. The values of the activation energy of dehydration, the pre-exponential factor in Arrhenius equation and the change of entropy for the formation of the activated complex were calculated using the calculation procedure of Coats and Redfern. Thermal stability and activation energy of dehydration of the crystallohydrates were found to increase by the same order. The relationships observed were interpreted using Klopman’s generalized perturbation theory of chemical reactivity. The same theory was applied to explain the differences in the IR spectra of the selenite crystallohydrates studied. 相似文献
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Field-induced reentrant novel phase and a ferroelectric-magnetic order coupling in HoMnO3 总被引:1,自引:0,他引:1
A reentrant novel phase is observed in the hexagonal ferroelectric HoMnO3 in the presence of magnetic fields in the temperature range defined by a plateau of the dielectric constant anomaly. The plateau evolves with fields from a narrow dielectric peak at the Mn-spin rotation transition at 32.8 K in zero field. The anomaly appears both as a function of temperature and as a function of magnetic field without detectable hysteresis. This is attributed to the indirect coupling between the ferroelectric (FE) and antiferromagnetic (AFM) orders, arising from an FE-AFM domain wall effect. 相似文献