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151.
D. G. Sannikov 《Physics of the Solid State》1997,39(7):1139-1142
A theoretical temperature-electric field phase diagram is constructed for thiourea SC(ND2)2 using a phenomenological approach based on the representation of the thermodynamic potentials for all phases. The theoretical
diagram is compared with the experimental diagram.
Fiz. Tverd. Tela (St. Petersburg) 39, 1282–1286 (July 1997) 相似文献
152.
A. Jarid M. Aaid Y. Legoux J. Merini M. Loudet D. Gonbeau G. Pfister-Guillouzo 《Chemical physics》1991,150(3):353-360
The electronic and structural characteristics of CrF5, CrF4, RuF5 and RuF4 were studied. Ab initio (SCF-CI) calculations were performed with different structures and spin states for each complex. The favored conformation always corresponds to the highest multiplicity: doublet for CrF5 in D3h, triplet for CrF4 in Td, quadruplet for RuF5 in C4v and quintuplet for RuF4 in D4h symmetry. 相似文献
153.
In this work, on the basis of a semiempirical model of bonding forces that allows for three-particle interaction and uses the pseudopotential method, the mechanical and electrical properties of barium chalcogenides are studied at hydrostatic pressure. Equations of state are formulated from hydrostatic compression, parameters of the type B1–B2 structural phase transitions are calculated, the change in the energy band spectrum under the influence of the pressures is studied, and an estimate is made of the critical amount of compression that induces a dielectric-metal phase transition. The results obtained are in agreement with the available data.Translated from Izvestiya Vysshikh Uchebnykh Zavedenii, Fizika, No. 11, pp. 44–52, November, 1991. 相似文献
154.
155.
156.
J. C. S. Moraes E. M. Telles F. C. Cruz A. Scalabrin D. Pereira C. Garelli N. Ioli A. Moretti F. Strumia 《International Journal of Infrared and Millimeter Waves》1991,12(12):1475-1486
We report the discovery of 57 new fir laser lines from13CD3OH molecule optically pumped by a waveguide CO2 laser of 300 MHz tunability. For all lines, precise frequency offset measurements between the CO2 line center and the center of the absorbing13CD3OH line were performed using the transferred Lamb-Dip technique. We have also measured directly the frequency of seven FIR laser lines by heterodyning with already known laser lines. We present a complete list of all known laser lines (134) and frequency measurements (24) for this molecule.Work supported by CNPq, FAPESP, FAEP-Brasil, and CNR-Italia 相似文献
157.
The structure of the nematic-isotropic interfacial layer is studied theoretically for systems formed by rod-like and persistent macromolecules. It is shown that the width of interfacial layer is normally of the order of the straight part of a molecule. This allows us to use the approach which describes intermolecular interactions phenomenologically (i.e. it allows us to consider all interactions), at the same time this approach describes molecular flexibility microscopically (i.e. it allows us to study the effects of flexibility correctly). It was found, that non-monotonic gradient profiles in the surface layer of the order parameter or of the concentration of molecules as a function of the coordinate perpendicular to the interface are possible. For example, a thin layer with abnormal ordering of molecules along the surface may exist near the interface for some systems. 相似文献
158.
Kinetics of oxidation of indigo carmine (IC) by sodium hypohalites, NaOX (X ? Cl or Br), in alkaline buffer of pH 9–11 has been studied spectrophotometrically at λ = 610 nm. The experimental rate law obtained is ?d[IC]/dt = k[OX?][IC][OH?]x where x <1. Variation of ionic strength or dielectric constant of the medium had no effect on the reaction rate while the addition of halide ions slightly retarded the rate. A most plausible mechanism proposed on the basis of experimental results involves the formation of isatin sulphonate which undergoes further oxidation to anthranilate. Activation parameters have been evaluated. 相似文献
159.
J. S. Vrentas D. C. Venerus C. M. Vrentas 《Journal of Polymer Science.Polymer Physics》1991,29(5):537-545
An integral constitutive equation which includes strain-coupling effects is proposed. The constitutive equation is more general than the K-BKZ equation, and it is shown that this equation can explain various important aspects of double-step stress-relaxation data. 相似文献
160.
Muonium in liquid SiCl has been observed for the first time at low temperature (−65°C) The observed polarization of muonium
is as much as 25% of the total spin polarization and shows a fast relaxation rate. 相似文献