Structural transformations of K<Subscript>3</Subscript>H(SO<Subscript>4</Subscript>)<Subscript>2</Subscript> crystals with variations in temperature

Single crystals of the K₃H(SO₄)₂ compound are investigated using X-ray diffraction on Xcalibur S and Bruker diffractometers. The structure of the low-temperature monoclinic phase is refined (space group C2/c, z = 4, a = 14.698(1) Å, b = 5.683(1) Å, c = 9.783(1) Å, β = 103.01(1)°, T = 293 K, Bruker diffractometer), the structural phase transition is revealed, and the structure of the high-temperature trigonal phase is determined (space group R \(\bar 3\) m, z = 3, a = 5.73(1) Å,c = 21.51(1) Å,T = 458 K, Xcalibur diffractometer).     

Über Kristallstruktur und elektrische Eigenschaften der Wismutselenide Bi2Se2 und Bi2Se3

The properties of bismuth triselenide (Bi₂Se₃) are already known to a certain extent through the work of several authors, while it was still an open question whether there exists an individual solid phase of BiSe. Further information on this subject could be obtained by the successful growth and investigation of single crystals of both Bi₂Se₃ and Bi₂Se₂. X-ray analysis by means of goniometry, Weißenberg, Laue, and Debye-Scherrer diagrams confirmed the known crystal structure of Bi₂Se₃ (ditrigonal scalenohedral;D _3d ⁵ ?R—m; with the hexagonal axes:a=4·15 Å andc=28·55 Å, and 3 molecules per unit cell). As to Bi₂Se₂ it can be shown that it belongs to the same class but to a different space group (D _3d ¹ ?P— 1m orD _3d ³ ?P—m 1; hexagonal axes:a=4·15 Å,c=22·84 Å, unit cell: 3 molecules, if the formula Bi₂Se₂ is adopted). Common to both is a subcell with the dimensions:a′=a=4·15 Å andc′=5·71 Å. The temperature dependence of electrical conductivity and Hall coefficient was measured on several specimens having different crystal orientations. The most striking difference is the high anisotropy of Bi₂Se₃ (σ _a σ _c =10) as compared with Bi₂Se₂ (σ _a /σ _c <2). All specimens turned out to ben-type. The room temperature carrier concentration observed was:n (Bi₂Se3)=8·10¹⁸ cm^?3 andn (Bi₂Se₂)=4·10²⁰ cm^?3, the carrier mobility:μ(Bi₂Se3)=2·10³ cm²/V·s andμ(Bi₂Se₃)=20 cm²/V·s.     

Synthesis,Crystal Structure and Luminescent Properties of Some Zn(II) Schiff Base Complexes: Experimental and Computational Study

A series of Zn(II)-Schiff bases I, II and III complexes were synthesized by reaction of o-phenylenediamine with 3-methylsalicylaldehyde, 4-methylsalicylaldehyde and 5-methylsalicylaldehyde. These complexes were characterized using FT-IR, UV-Vis, Diffuse reflectance UV-Vis, elemental analysis and conductivity. Complex III was characterized by XRD single crystal, which crystallizes in the triclinic system, space group P-1, with lattice parameters a?=?9.5444(2) Å, b?=?11.9407(2) Å, c?=?21.1732(3) Å, V?=?2390.24(7) ų, D _c ?=?1.408 Mg m^?3, Z?=?4, F(000)?=?1050, GOF?=?0.981, R1?=?0.0502, wR2?=?0.1205. Luminescence property of these complexes was investigated in DMF solution and in the solid state. Computational study of the electronic properties of complex III showed good agreement with the experimental data.     

Das Kernquadrupolmoment des Mn55

With a recording photoelectric Fabry-Perot spectrometer and an atomic-beam light source the hyperfine structure of the Mn I-resonance linesλ=4031 Å,λ=4033 Å,λ=4034 Å (3d ⁵4s ² a ⁶ S _5/2?3d ⁵4s4p z ⁶ P _7/2,5/2,3/2 ⁰)and of the inter-combination linesλ=5395 Å andλ=5433 Å (3d ⁵4s ² a ⁶ S _5/2?3d ⁵4s4p z ⁸ P _7/2,5/2 ⁰) was measured. Furthermore the resonance lines have been measured with a pulsed atomic-beam in absorption. In this case the quotient (I ₀(ν)?I(ν))/I ₀(ν) was recorded, whereI(ν)=I ₀(ν) exp(?α(ν)d) is the observed intensity with absorption andI ₀(ν) the intensity of the light source. From the hyperfine structure splitting the value of the electric quadrupole moment of Mn⁵⁵ was derived to be:Q(Mn⁵⁵)=+(0.35±0.05)·10^?24 cm².     

Zur Isomerie des Tl197

Tl^197m was produced by the (α, 4n) reaction on Au¹⁹⁷ using 49 MeVα particles. The following results were obtained: Half-lifeT _1/2=(0.55±0.02) sec; energy of the isomeric level (607±4) keV, determined directly by summing up the cascade transitions in a well-type scintillator; energy of the isomeric transition (222±2) keV; conversion coefficients of this transitionα _K222=0.41±0.05 andα _tot222=2.1±0.2, indicating anE3 multipolarity; energy of the second transition (385±3)keV; conversion coefficientsα _K385=0.09±0.03 andα _tot385<0.1. This transition was identified asE2 with aM1 admixture of 20 to 30%. Spins and parities are 1/2⁺, 3/2⁺ and 9/2^? for the ground state, the 385 keV state and the 607 keV isomeric state, respectively, in disagreement with the extreme single-particle model. If this model were correct, anotherM1 transition should appear. No furtherM1 transition having an energy greater than theL-shell binding energy of T1 was observed.     

Intersubband cyclotron resonance of holes in strained Ge/GeSi(111) heterostructures with germanium wide quantum wells and cyclotron resonance of 1<Emphasis Type="Italic">L</Emphasis> electrons in GeSi layers

The submillimeter (?ω=0.5–5 meV) magnetoabsorption spectra of strained Ge/Ge_1?xSi_x(111) multilayer heterostructures with thick Ge layers (d_Ge=300–850 Å, d_GeSi≈200 Å, x≈0.1) are investigated at T=4.2 K upon band-gap optical excitation. It is revealed that the absorption spectra contain cyclotron resonance lines of 1L electrons localized in GeSi solid solution layers (unlike the previously studied structures with thin Ge layers as quantum wells for 3L electrons). The absorption spectra of the samples with thick Ge layers (d_Ge=800–850 Å) exhibit cyclotron resonance lines of holes due to transitions from the lower Landau levels in the first quantum-well subband to the Landau levels belonging to the third and fifth higher subbands.     

Synthesis and electrical conductivity of a new Ag<Subscript>6</Subscript>SnS<Subscript>4</Subscript>Br<Subscript>2</Subscript> superionic compound

The conditions of synthesizing a new Ag₆SnS₄Br₂ compound were studied. The crystallographic parameters of the unit cell were determined as follows: space group Pnma, a=6.67050(10) Å, b=7.82095(9) Å, c=23.1404(3) Å, and Z=4. The total electrical conductivity and its ionic component were measured by a dc probe method in the temperature range 210–380 K. Kinks in the conductivity curve and the differential thermogram of heating the alloy were revealed at 235 K. It was concluded that the mass and charge transfers in the compacted Ag₆SnS₄Br₂ alloy powder have an intragrain character.     

Messungen derK-Konversionskoeffizienten und der Aktivierungsquerschnitte der isomeren Atomkerne Se77m,Se79m,Ge75m und Ge77m

TheK-conversion coefficients α _K of the nuclear isomers Se^77m , Se^79m , Ge^75m and Ge^77m have been measured by detecting theK-röntgen- andγ-radiation from neutron-irradiated Se- and GeO₂-samples with the aid of scintillation counters to be α _K =0.79±0.06, 7.4±0.6, 1.44±0.13, and 1.2±0.6, respectively. In all cases, the values obtained, are in agreement with those taken from the tables ofRose under the assumption of anE3-transition, thus confirming this assignment which was proposed earlier by other authors. In addition, the cross sectionsσ for inducing the activities by slowed down neutrons have been measured to beσ=22±2, 0.40±0.04, 0.20±0.02, and 0.12±0.03 barns, respectively, and are compared with earlier data of several authors.     

Effect of desiccant on the performance of green organic light-emitting device

A green organic light-emitting diodes (OLED) with a multilayer structure of indium-tin oxide (ITO)/copper-phthalocyanine (CuPc) (200Å)/N,N′-bis(1-naphthyl)-N,N′-diphenyl-1,1′-biphenyl-4,4′-diamine (α-NPD) (600Å)/N′- diphenyl-N,N′-tris(8-hydroxyquinoline) aluminium (Alq₃) (400Å):10-(2-benzothiazolyl)-1,1,7,7-tetramethyl-2,3,6,7- tetrahydro-1H,5H,11H-(l)benzopyropyrano(6,7,8-i, j)quinolizin-11-one (C545T) (2%)/Alq₃ (200Å)/LiF (10Å)/Al (1000Å) was prepared via vacuum thermal evaporation. To reduce the impact of water vapor and oxygen on the device, we encapsulated it with a kind of specific and efficient desiccant, called DESIPASTE, under the protection of high-purity nitrogen. By analyzing a series of optical characteristics of OLEDs, the results showed that this desiccant can improve the brightness about 500 and 250 cd/m² at same driving voltage and current density, respectively. The electroluminescent (EL) spectra were hardly affected except a very weak blue shift of broadband emission peak. It turns out that encapsulation with DESIPASTE is a simple and efficient way to improve the performance of OLED.     

Measurement of the Lamb shift 42S1/2-42P1/2 of the helium ion

Helium ions were produced in then=4 states by electron collisions with ground state atoms, resulting in simultaneous ionization and excitation. Dipole transitions between the Zeeman levels of the states 4² S _1/2 and 4² P _1/2 were induced by a microwave electric field. The intensity of the emitted Fowlerα line 4686 Å, corresponding to transitions from then=4 to then=3 states was then reduced by about 3%. From the measurements, a value of the Lamb shiftδ=1751±25 MHz was obtained, compared with the theoretical valueδ=1768.23±0.55 MHz, and the results ofLea, Leventhal andLamb ofδ=1765±20 MHz.     

Synthesis,growth and characterization of L-proline dimercuricchloride single crystals for frequency conversion applications

A semi-organic nonlinear optical L-proline dimercuricchloride (LPDMC) material has been synthesized. LPDMC single crystals were grown from aqueous solution by a slow cooling method. Good quality single crystals of size 19×6×3 mm³ have been grown over a period of 3 weeks. The grown crystals have been subjected to single crystal X-ray diffraction analysis to determine the cell parameters. The title compound crystallizes in the triclinic system with a noncentrosymmetric space group P1 and with unit-cell parameters a=7.2742(4) Å, b=9.4472(5) Å, c=10.4767(6) Å, α=108.621(3)^°, β=107.260(2)^°, γ=97.353(2)^° and volume=631.51(6) Å³. Optical and dielectric properties of the crystals have been studied. The thermal stability of the crystals was determined by thermogravimetric analysis/differential thermal analysis. The second harmonic generation efficiency of the crystals was obtained by the classical powder technique using a Nd:YAG laser and it is found to be 2.5 times that of potassium dihydrogen phosphate.     

Der Zerfall Co58m →Co58g

Co^58m , Co^58g and Co⁵⁵ were obtained by radiating nickel-foiles with deuterons of energies 11,5 MeV and 2,07 MeV. The γ-radiation was measured with NaJ scintillation spectrometers. For the isomeric transition of Co^58m was determinedT _1/2=(9.15±0.1)h,T _γ=(25±1)keV,α _K=2200±300 and α_L+M=1100±300. From these values it follows, that the radiation is ofM3-type. Twoγ-energies of 95 keV and 1322 keV were found belonging to Co⁵⁵.     

A new crystalline HMX polymorph: ɛ-HMX

A new crystalline HMX polymorph, ?-HMX, was obtained. ?-HMX crystals were studied by X-ray structure analysis, optical microscopy, and differential scanning calorimetry. Their space group is P2₁/c. The unit cell parameters are a = 21.799(3) Å, b = 10.913(2) Å, c = 10.819(2) Å, and β = 97.43(2)°, V = 2552.15 ų, Z = 4. ?-HMX molecules are not equivalent in crystals and have chair conformations. The heat of the polymorphic transition of ?-HMX into the δ-polymorph was measured. The transition occurred with the intermediate formation of β-HMX. The dependence between the heats of polymorphic transitions and the densities of crystals of various HMX polymorphs was demonstrated. The character of this dependence was to a substantial extent determined by the type of HMX molecule conformation.     

Spin-selective low temperature spectroscopy on single molecules with a triplet-triplet optical transition: Application to the NV defect center in diamond

The spin-selective photokinetics of a single matrix-isolated impurity molecule with a triplet-triplet optical transition, T ₀–T ₁, is considered and the manifestations of the photokinetics in the fluorescence excitation spectra and intensity autocorrelation functions g ⁽²⁾(τ) of the molecule undergoing narrow-band optical excitation is studied to resolve the fine structure of the transition. The rates of intersystem crossings (ISCs) T ₁→S→T ₀ to and from a nonradiating singlet state S of the molecule and the rate of population relaxation among the ground (T ₀) state sublevels can be obtained from the spectra and g ⁽²⁾(τ) using the analytical expressions obtained. New experiments on an individual NV defect center in nanocrystals of diamond, where, for the first time, the fine structure of its triplet-triplet ³ A-³ E zero-phonon optical transition (~637 nm) at 1.4 K was resolved, are interpreted. It is concluded that the rate of the ISC transition from the m _S =0 sublevel of the excited ³ E state to the singlet ¹ A state (~1 kHz) is much slower than the rates from the m _S =±1 substates, while the rates of ISC transitions to different m _S substates of the ground ³ A state are close to each other (~1 Hz). As a result, only the optical transition between m _S =0 sublevels in the ³ A-³ E manifold contributes strongly to the fluorescence. The experimentally observed double-exponential decay of the g ⁽²⁾(τ) function is explained by the two pathways available to the center for it to leave the S state: (i) the S→ T ₀(m _S )=0) transition and (ii) the S→T ⁰(m _S =±1) transitions followed by the slow spin-lattice relaxation T ₀(m _S =±1)→T ₀(m _S =0) (rate ~0.1 Hz). The work is important for studies where the NV center is used as a single photon source or for quantum information processing.     

Thermopower in the region of hopping conduction in TlNiS<Subscript>2</Subscript>

Samples of the composition TlNiS₂ in the hexagonal system with the unit cell parameters a=12.28 Å, c=19.32 Å, and ρ=6.90 g/cm³ are synthesized. The results of the investigation into the electrical and thermoelectrical properties of TlNiS₂ samples in the temperature range 80–300 K indicate that TlNiS₂ is a p-type semiconductor. It is found that, at temperatures ranging from 110 to 240 K, TlNiS₂ samples in a dc electric field possess variable-range-hopping conduction at the states localized in the vicinity of the Fermi level. The density of localized states near the Fermi level is determined to be N_F=9×10²⁰ eV^?1 cm^?3, and the scatter of the states is estimated as J≈2×10^?2 eV. In the temperature range 80–110 K, TlNiS₂ exhibits activationless hopping conduction. At low temperatures (80–240 K), the thermopower of TlNiS₂ is adequately described by the relationship α(T)=A+BT, which is characteristic of the hopping mechanism of charge transfer. In the case when the temperature increases to the temperature of the onset of intrinsic conduction with the activation energy ΔE=1.0 eV, there arise majority intrinsic charge carriers of both signs. This leads to an increase in the electrical conductivity σ and, at the same time, to a drastic decrease in the thermopower α; in this case, the thermopower is virtually independent of the temperature.     

Der Zerfall des Tb158m

Tb^158m was produced from Tb¹⁵⁹ by (n, 2n) reaction and investigated using scintillation spectrometers. The following results were obtained: half-life\(T_{\tfrac{1}{2}} = (10.5 \pm 0.2)\) sec; energy of the isomeric transitionE _γ =(109.9±1.4) keV; conversion coefficients α _K =56±3; α _L +α _M +?=50±8; α_total=106±10;K/L-ratioK/L=1.3±0.3, yielding the multipole order of the isomeric transition to beM3. Upper limits for the direct beta transitions from the isomeric state to the ground states of the neighbouring even-even nuclei Gd¹⁵⁸ and Dy¹⁵⁸ are 10^?4 and 6·10^?3, respectively.     

Rigidity and Non-local Connectivity of Julia Sets of Some Quadratic Polynomials

For an infinitely renormalizable quadratic map \({f_c: z\mapsto z^2+c}\) with the sequence of renormalization periods {k _m } and rotation numbers {t _m  = p _m /q _m }, we prove that if \({\limsup k_m^{-1} \log |p_m| >0 }\), then the Mandelbrot set is locally connected at c. We prove also that if \({\limsup |t_{m+1}|^{1/q_m} <1 }\) and q _m → ∞, then the Julia set of f _c is not locally connected and the Mandelbrot set is locally connected at c provided that all the renormalizations are non-primitive (satellite). This quantifies a construction of A. Douady and J. Hubbard, and weakens a condition proposed by J. Milnor.     

Substitution effects on the bulk and surface properties of (Li,Ni)Mn<Subscript>2</Subscript>O<Subscript>4</Subscript>

Manganese oxides of spinel structure, LiMn₂O₄, Li_1-x Ni _x Mn₂O₄ (0.25 ≤ x≤ 0.75), and NiMn₂O₄, were studied by EDS, XRD, SEM, magnetic (M-H, M-T), and XPS measurements. The samples were synthesized by an ultrasound-assisted sol-gel method. EDS analysis showed good agreement with the formulations of the oxides. XRD and Rietveld refinement of X-ray data indicate that all samples crystallize in the Fd3m space group characteristic of the cubic spinel structure. The a-cell parameter ranges from a = 8.2276 Å (x = 0) to a = 8.3980 Å (x = 1). SEM results showed particle agglomerates ranging in size from 2.3 μm (x = 0) down to 0.8 μm (x = 1). Hysteresis magnetization vs. applied field curves in the 5–300K range was recorded. ZFC-FC measurements indicate the presence of two magnetic paramagnetic-ferrimagnetic transitions. The experimental Curie constant was found to vary from 5 to 7.1 cm³ K mol^?1 for the range of compositions studied (0 ≤ x ≤ 1). XPS studies of these oxides revealed the presence of Ni²⁺, Mn³⁺, and Mn⁴⁺. The experimental Ni/Mn atomic ratios obtained by XPS were in good agreement with the nominal values. A linear relationship of the average oxidation state of Mn with Ni content was observed. The oxide’s cation distributions as a function of Ni content from x = 0 ?Li⁺[Mn³⁺Mn⁴⁺]O₄ to x = 1 \( {\mathrm{Ni}}_{0.35}^{2+}{\mathrm{Mn}}_{0.65}^{3+}\left[{\mathrm{Ni}}_{0.65}^{2+}\right.\left.{\mathrm{Mn}}_{1.35}^{3+}\right]{\mathrm{O}}_4 \) were proposed.     

Messung derL-Auger-, Fluoreszenz- und Coster-Kronig-Ausbeuten von Gold

An apparatus is described, with which, for the first time, the spectra of Augere-lectrons and of X-rays, produced by the impact of electrons, were measured simultaneously. The electron spectrometer was a magnetic 180°-spectrometer with a half-width of 0·5%. The X-ray spectrometer was a NaJ-crystal with a photomultiplier. The electron- and the X-rays were produced in metallic foils of a thickness of 50 Å by the impact of 55-keV-electrons. The knownK-fluorescence-yields of copper and selenium were used to determine the various yields for theL-shells of gold. TheL-fluorescence-yields areω _L1 =0·08±0·01;ω _L2 =0·26±0·03;ω _L3 =0·24±0·02.     

Bestimmung des elektrischen Kernquadrupolmomentes des ungeraden stabilen Strontium-87-Kerns

In order to determine the electric quadrupole moment of Sr⁸⁷ (I= 9/2) the hyperfine structure-splitting of the 5s5p ³ P ₁-state of the SrI-spectra was investigated by optical double resonance. By detection of high frequency transitions (ΔF=±1,Δm _F=0,±1) in an external magnetic fieldH ₀≈0 one obtains the hyperfine structure separations asv _F=11/2?F=9/2=1463·149 (6) Mc/sec andv _F=9/2?F=7/2=1130·264 (6) Mc/sec. From these frequencies one calculates the magnetic hyperfine structure-splitting constantA=?260·084 (2) Mc/sec and the electric quadrupole interaction constantB=?35·658 (6) Mc/sec. B leads to an electric quadrupole moment ofQ(Sr⁸⁷)=+0·36 (3)·10^?24 cm².