Classical behaviour of the soliton density in Rb2ZnCl4 studied by 87Rb NMR

The temperature dependence of the soliton density n_s(T) which has been studied in Rb₂ZnCl₄ by ⁸⁷Rb NMR could be fitted to a classical formula using only one fit parameter. From our data we cannot confirm recent experimental results which yield a critical exponent $\text{1}\text{2}$ for the soliton density. The results are discussed with respect to the free energy where the soliton density acts as the order parameter. Moreover, couplings to other degrees of freedom, e.g. the elastic strains, are considered.     

Angle-selective measurements of spin soliton in ladder polydiacetylene by pulsed 94 GHz EPR

Angle-selection experiments of a spin soliton in randomly oriented ladder polydiacetylene were carried out by pulsed electron paramagnetic resonance (EPR) at W-band. EPR measurement using 94 GHz microwaves increased the difference in the resonance field due tog anisotropy of the spin soliton to allow the orientation dependence of transient nutation, electron nuclear double resonance (ENDOR) and spin relaxations to be investigated. The shape of theg anisotropy-resolved nutation spectrum was discussed on the basis of the EPR transition moments and the differences between spin relaxation times. Reliable assignments of hyperfine couplings to the β protons (H_β) of the alkyl side chains were achieved with the support of W-band ENDOR measurements. No significant orientational dependence in theT ₁ andT ₂ processes was found in terms of isotropy of the H_β-hyperfine interaction.     

Charge transport at mid-gap in trans-(CH)x: An electrochemical study

Electrochemical studies demonstrate that ～300 ppm of charge (equal to the number of neutral solitons in undoped $\text{trans}$-(CH)_x) is removed at mid-gap. These charges are transported through the polyacetylene electrode via hopping among states at the center of the energy gap, in agreement with Kivelson's theory. From analysis of the data, we have been able to determine the soliton creation energy, E_s ? 0.5eV, which is in good agreement with the theoretical value, E_s = (2/π)Δ.     

Fractional charges at finite temperature and chemical potential

The behaviour of the fermion charge Q localized on soliton at finite temperature T and chemical potential α is investigated in the one-dimensional continuum model of the linear diatomic polymer. It is shown that the depletion of the fermion charge takes place when T and α tend to its critical values. In the case of the spinless trans-polyacetylene model and N = 1 Gross-Neveu model the discontinuity of the value of Q at α_c is obtained whereas in the model φ⁴ with fermions the continuous transition to zero value of Q(α) occurs.     

Reinvestigation of microwave spectrum, molecular structure, dipole moment, and theoretical calculation of s-trans (E)- and s-trans (Z)-acrylaldehyde oxime

The spectroscopic constants of s-trans (E)-acrylaldehyde oxime of normal, CH₂CHCHNOH, and deuterated, CH₂CHCHNOD, species were refined by adding a-type R-branch transitions observed in the frequency range of 34-40 GHz in the ground vibrational state. For s-trans (Z) form, the spectroscopic constants of normal species were refined by refitting the reported frequencies with four b-type Q-branch transitions and those of deuterated species were determined by the least-squares fitting of the observed a-type R-branch transitions in the ground vibrational state. The spectroscopic constants of two isomers of normal species were also determined in the vibrationally excited states. The inertial defects (ΔI=I_c−I_a−I_b) of normal and deuterated species were determined to be −0.042(24) and −0.064(17) u Å² for s-trans (E)-1 form, and −0.0536(8) and −0.063(11) u Å² for s-trans (Z)-1 form, respectively. From the r_s coordinates of the hydroxyl hydrogen atom determined for s-trans (Z)-1 form, its OH bond was concluded to be at the trans position with respect to the CN double bond. The dipole moments of deuterated species of s-trans (E)-1 form and those of normal and deuterated species of s-trans (Z)-1 form were determined. The structural parameters of r(C₂C₃), ∠C₁C₂C₃, ∠C₂C₃N, and ∠C₃NO for s-trans (E)-1 and s-trans (Z)-1 forms were adjusted separately using to their rotational constants observed. It was found that the bond angle of ∠C₂C₃N in s-trans (Z)-1 form are much wider than that in s-trans (E)-1 form by about 10°. The difference between the observed and calculated (using MP2/6-311++G (d,p) level) rotational constants of s-trans (Z)-1 form was larger than that of s-trans (E)-1 form.     

Electronic states of the c is - and trans - H3ONO molecules: a CASPT2 study

The CASPT2 calculations for the S₀, T₁, S₁, T₂, and S₂ states of the cis- and trans-CH₃ONO molecules predict the energy levels and geometries of the cis- and trans-isomers in the different states. The CASPT2 adiabatic (T ₀) and vertical (T _v) excitation energies are in good agreement with available experimental data (for the S₁ cis- and trans-isomers). The CH₃O-NO dissociation potential energy curves were calculated at the CASPT2//CASSCF level, and the CASPT2 calculations were performed for the transition states along the T₁, S₁, and T₂ dissociation paths. For the repulsive S₂ state the calculations predict the T _v values larger than 5.4 eV and dissociation products of CH₃O (1²A″) + NO (X²Π).     

光子晶体波导中的孤子传输及其延迟特性研究

研究了正方晶格和三角晶格空气背景硅介质柱光子晶体线缺陷波导导模左带隙边缘处的亮孤子脉冲传播特性及其慢光延迟特性. 采用平面波展开法仿真分析了波导相邻两行介质柱大小r₁和r₂以及波导宽度D对孤子脉冲传输所需峰值功率P₀和延迟时间T_s的影响,总结了其变化规律. 通过调整波导结构得到了正方晶格和三角晶格优化波导结构,优化后,正方晶格结构波导P₀减小了81.17%,T_s增加了66.32%;三角晶格结构波导P₀减小了73.7%,T_s增加了67.63%,实现了孤子传输性能的大幅度优化. 关键词： 光子晶体波导 光孤子 峰值功率 延迟时间     

Rotational isomerism in 3-chloro-1-propanol from the microwave spectrum

The rotational spectra of two conformations of 3-chloro-propanol were observed for the four possible $\text{Cl(35)}\text{Cl(37)}$ and $\text{H}\text{D}$ isotopic species. For both conformations the oxygen atom is gauche with respect to the C₂C₃ bond and the hydroxyl hydrogen is trans with respect to the C₂C₁ bond. In one conformation (T) the chlorine is trans with respect to C₁C₂ and it is gauche in the other form (G). The ground state of the G form is about 0.7 kcal/mole more stable than that of the T form. A discussion is given about the failure to observe the H bond species. The most likely reason is the too close approach of Cl and O in this hypothetical configuration. The quadrupole coupling constants were obtained for the G form. The rotational spectra of five excited states of the T form and of one excited state of the G species were measured. Partial r₀ and r_s structures are given.     

Predominant factors affecting the dielectric and piezoelectric properties of bismuth-containing complex perovskite solid solution

To study the factors affecting the dielectric and piezoelectric properties of bismuth-containing complex perovskites, the solid solution (1−x)Pb(Mg_1/3Nb_2/3)O₃-xBi(Mg_2/3Nb_1/3)O₃ was prepared by the solid state reaction method and its dielectric and piezoelectric properties were investigated. It is found that (1) at room temperature, the nonlinearity of the DE-loop for Pb(Mg_1/3Nb_2/3)O₃ is completely suppressed at a rather low x (<5%); (2) dielectric constant versus temperature curves deviate from the Curie-Weiss law at a temperature T_d much higher than the dielectric constant peak temperature T_m and T_m−T_d decreases considerably with increasing x; and (3) frequency dispersion ΔT_m=T_m (1 MHz)−T_m (10 kHz) increases with increasing x. Possible factors responsible for the variation of the dielectric and piezoelectric properties with x are discussed.     

Nuclear magnetic resonance studies of CePd2In and LaPd2In at low temperatures

We report on In nuclear magnetic resonance (NMR) and nuclear quadrupolar resonance (NQR) measurements on the new heavy-electron compound CePdZIn over a wide temperature range, from 45 mK up to 30 K. CePd₂In undergoes an antiferromagnetic (AF) phase transition at T _N = 1.23 K involving small localised Ce moments of 0.11 μ_B. In zero field, the spin-lattice relaxation rate T ₁ ^?1 (T) shows remarkable changes in its temperature dependence. Above 3 K, T ₁ ^?1 is constant and 850 sec^?1. Between T _N and 2T _N, (T ₁ T)^?1 = 330 (Ksec)^?1, but rapidly decreases below T _N. A Korringatype relaxation, characteristic for simple metals at low temperatures, with (T ₂ T)^?1 = 17(Ksec)¹ is resumed below 0.6 K. This value is an order of magnitude larger than (T ₁ T)^?1 for LaPd₂In and therefore is associated with low-energy excitations of the itinerant charge carriers with 4f symmetry. The T ₁ ^?1 data at various non-zero magnetic fields fall on a single curve when plotted as a function of (T/H) if H exceeds 3.5 T. Thus the AF ordering, the 4f moment fluctuations and the Kondo screening are drastically suppressed by the application of fields H of the order of 3.5 T.     

Structural, magnetotransport and morphological studies of Sb-doped La2/3Ba1/3MnO3 ceramic perovskites

We report here the structural, magnetotransport and morphological studies of Sb-doped La_2/3Ba_1/3Mn_1−xSb_xO₃ perovskite manganites. Pristine material La_2/3Ba_1/3MnO₃ (LBMO) shows two insulator-metal (I-M) transitions in the electrical resistivity-temperature (ρ-T) behavior. While the higher temperature transition (T_P1) at ∼340 K is reminiscent of the usual I-M transition in manganites, the lower temperature transition (T_P2) at ∼250 K has been ascribed to the grain boundary (GB) effects arising out of the ionic size mismatch between the ions present at the rare-earth site (La³⁺ and Ba²⁺). With Sb-doping T_P1 shifts to lower temperatures while T_P2 remains invariant up to 3% and shifts to lower temperature for 5%. Room temperature electrical resistivity and the peak values also increase successively with Sb-doping. Scanning electron micrographs of the samples exhibit a gradual increase in their grain sizes with Sb indicating a gradual decrease in the GB density. Shift of T_P1 with doping is explained on the basis of a competition between double-exchange and super-exchange mechanisms. The overall electrical resistivity increases and the shift in the electrical resistivity hump (T_P2) with Sb-doping is found related to be gradually decreasing GB density and the ensuing lattice strain increase at the GBs. The intrinsic magnetoresistance (MR) gets suppressed and extrinsic MR gets enhanced with Sb-doping. At T>T_P1, the electrical resistivity is found to follow the adiabatic polaron hopping model whereas the electron-magnon scattering is found to dominate in the metallic regime (T<T_P1).     

Sb Magnetic Resonance as a Local Probe for the Gap Formation in the Correlated Semimetal FeSb2

We report on a comparative study of the narrow-band semimetals FeSb₂ and its structural homologue RuSb₂ by means of ^121,123Sb nuclear quadrupole (NQR) and nuclear magnetic resonance (NMR) spectroscopy. From NQR for both compounds two temperature regimes could be identified by use of ¹²³(1/T ₁) measurements. Above 40 K a conventional activated behavior (with Δ/k _B ? 400 K for FeSb₂) dominates in ¹²³(1/T ₁), whereas below 40 K in both systems an unconventional ¹²³(1/T ₁) behavior with a smooth maximum at around 10 K is observed. To analyze this behavior, we propose the presence of T-dependent in-gap states forming a narrow energy level of localized spins with S = ½ near the bottom of the conduction band. These states might have originated from an inherent Sb-deficiency in both compounds. This model enables us to fit the ¹²³(1/T ₁) data in the entire investigated temperature range (2–200 K) for FeSb₂. Ab initio band structure calculations reveal more than a factor of two larger Δ value for RuSb₂ as compared with FeSb₂. This results in dissimilar behavior of ¹²³(1/T ₁) in FeSb₂ and RuSb₂ above 40 K evidencing the inefficiency of thermal activation of electrons over the large energy gap at T ≤ 300 K in RuSb₂ and dominating of quadrupole relaxation channel in RuSb₂ in this temperature range caused by phonon relaxation involving two-phonon (Raman) scattering. In addition, extra wide range field-sweep NMR measurements are performed at various temperatures on FeSb₂ and RuSb₂. The complex broad spectra could be modeled and from the shift of the ¹²¹Sb central transition the 3d component of the shift K _3d (T) could be extracted.     

Preparation and low field magnetoresistance of double layered manganite La1.4Ca1.6Mn2O7

Double layered manganite of La_1.4Ca_1.6Mn₂O₇ (DLCMO) was prepared using solid state reaction method and had a metal-insulator transition temperature (T_MI) of 125 K. The short range 2D-feerromagnetic ordering (T_C2) starts growing when T<168 K and it gets converted into 3D-ferromagnetic ordering (T_C1) at 114 K. Low field magnetoresistance (MR) behaviour of the DLCMO was investigated and compared with an infinite layered manganite La_0.7Ca_0.3MnO₃ (LCMO). For DLCMO, in the temperature range between T_C1 and T_C2, the MR showed a gradual increase with the magnetic field. The observed MR and R-T behaviour of double layered manganite for T_C1<T<T_C2 has been explained in the frame work of the two phase model [ferromagnetic (FM) domains and paramagnetic (PM) regions] and percolative behaviour of transport in FM-PM mixture.     

Decay properties of the 19/2− isomers in113,117Sb

By means of the generalized centroid-shift method, the following half-lives were determined:T _1/2(3045 keV)=3.7±0.3 ns in¹¹³Sb using the reaction¹⁰⁴Pd(¹²C,p2n) as well asT _1/2 (1322.8 keV)=3.5±0.3 ns,T _1/2(2779.8 keV) =0.50±0.15ns,T _1/2(2874.9 keV)<0.2 ns andT _1/2(3072.9 keV)<0.1 ns in¹¹⁷Sb using the¹¹⁶In(α, 2n) reaction. Three-quasiparticle configurations of the type πd _5/2ν(h_11/2 d _3/2) in^113,117Sb are found to dominate in the wave functions of the 19/2^? states at 3045 and 2780 keV in¹¹³Sb and¹¹⁷Sb, respectively. TheB(E2, 19/2^? → 15/2^?) values in^113–119Sb are discussed.     

Spin dynamics in trans-polyacetylene

Detailed spin-echo and cw EPR measurements on trans-(CD)_x and trans-(CH)_x are reported. The magnitude of the on-chain diffusion rate, and its temperature dependence are evaluated. The results do not agree with predictions of the soliton model nor with results evaluated from recent NMR measurements.     

Optical solitons in dense resonant media

Exact single-soliton solutions of the modified system of Maxwell-Bloch equations, in which the dipole-dipole interactions of the atoms of a dense resonant medium are taken into account, are obtained. Two propagation regimes are analyzed: “coherent,” where the pulse duration is much shorter than both relaxation times (T _p ? T ₁, T ₂), and “incoherent,” where the pulse duration falls between the relaxation times (T ₂ ? T _p ? T ₁). It is predicted, for the first time, that soliton propagation of an ultrashort pulse is possible in a dense resonant absorbing medium in an incoherent interaction regime. The differences between the amplitude and phase characteristics of the solitons considered and the corresponding characteristics of the solitons for McCall-Hahn self-induced transparency are noted.     

Bose-Einstein solitons in time-dependent linear potential

In this paper, Bose-Einstein soliton solutions of the nonlinear Schrödinger equation with time-dependent linear potential are considered. Based on the F-expansion method, we present a number of Jacobian elliptic function solutions. Particular cases of these solutions, where the elliptic function modulus equals 1 and 0, are various localized solutions and trigonometric functions, respectively. Specially, for V_ext = ZF(T) = Z[mg + Hcos (ω₁T)], we discussed the Bose-Einstein condensate trapped in the coupling external field with considering the effect of gravity; for F(T) = constant, it describes the wave (Langmuir or electromagnetic) in a linearly inhomogeneous plasma with cubic nonlinearly.     

Spectral manifestations of the splitting of the lowest triplet levels in Pd complexes of nonsymmetric porphyrins

Based on the study of the phosphorescence and phosphorescence excitation spectra of Pd(II) tetramethylporphyrin (PdTMP) and Pd(II) tetramethyldiethylporphyrin (PdTMDEP) in solutions in 2-methyltetrahydrofuran and dodecane in the temperature range 77–283 K, the occurrence of the splitting of the lowest degenerate singlet (S ₁) and triplet (T ₁, T ₂) levels of porphyrin molecules is established. In the absorption of molecules of the compounds studied, two components, S ₁ and S ₂, are revealed in the range of allowed long-wavelength Q(0,0) transitions (530–550 nm) and four components, T ₁–T ₄, are observed in the range of spin-forbidden intersystem crossing transitions S ₀ → T _n (560–670 nm), with all the triplet levels T ₁-T ₄ being located below the S ₁ level on the energy scale. It is shown that an increase in the degree of deformation of the porphyrin macrocycle caused by steric interactions between β alkyls and hydrogen meso atoms is accompanied by an increase in the splitting in the system of singlet levels δE(S ₂–S ₁) from 120 cm^?1 for PdTMDEP to 215 cm^?1 for PdTMP, as well as by an increase in the splitting in the system of triplet levels δE(T ₂–T ₁) from 190 cm^?1 for PdTMDEP to 250 cm^?1 for PdTMP.