High-Resolution Spectroscopy of Jet-Cooled (32)SO(2) and (34)SO(2): The ã(3)B(1)-;X(1)A(1), 2(1)(0) and 1(1)(0) Bands

Laser-induced excitation spectra of the two bands ?(3)B(1)-;X(1)A(1), 2(1)(0) and 1(1)(0) of (32)SO(2) and (34)SO(2) have been recorded in a supersonic jet at a resolution of 0.015 cm(-1). The rotational and electron-spin fine structure has been analyzed for both isotopic species. Analysis of the rotational and electron-spin fine structure yields precise values of the rotational constants A, B, and C and the spin constants alpha and beta for both (32)SO(2) and (34)SO(2) in the states ?(3)B(1) (010) and (100). No interaction between these two vibrational states with any nearby triplet state is observed for rotational levels with J 相似文献   

(E)-3-(4一羟苯基)-1-(哌啶-1-基)丙-2-烯-1-酮衍生物核磁共振特征与构象分析

设计并合成了一系列(E)-3-(4-羟苯基)-1-(哌啶-1-基)丙-2-烯-1-酮衍生物. 通过一维和二维核磁共振实验完成了¹H和¹³C信号的指认. 通过ROESY、变温实验和分子模拟技术对这类化合物的构象进行了分析.     

Entangled Eigenvectors of Scalar Fields φ1(x) - φ2(x) and П1(x) + П2(x)

We first demonstrate the precise Einstein-Podolsky-Rosen entanglement, which is inherent in quantum mechanics, in the context of quantum theory of complex scalar fields. We explicitly derive the entangled common eigenstates of φ₁(x) - φ₂(x) and П₁(x) + П₂(x) φ₁and φ₂ are two real components of the complex scalar field, and П₁ and П₂ are the corresponding conjugate fields) in the Fock space. The entangled eigenstates span a complete and orthonormal representation.     

119Sn Mössbauer, NMR (1H, 13C and 119Sn) and infrared study of tetracoordinated tin(IV) complexes with 4-[((E)-1-{2-hydroxy-5-[(E)-2-(aryl)-1-diazenyl]phenyl}methylidene)amino]benzoates

A series of organotin(IV) complexes of composition R₃Sn[O₂CC₆H₄{N= C(H)C₆H₃-2-OH(N=NC₆H₄R)}-p] (R = Ph or Bz; R = H, 2-CH₃, 3-CH₃, 4-CH₃) have been investigated by ¹¹⁹Sn Mössbauer, ¹H, ¹³C, ¹¹⁹Sn NMR and IR spectroscopic techniques. ¹¹⁹Sn Mössbauer data indicated a distorted tetrahedral geometry for the triphenyltin(IV) complexes while the tribenzyltin complexes exhibit a distorted trigonal bipyramidal coordination geometry with equatorial benzyl groups and the axial positions occupied by an O atom from the carboxylate ligand and the O atom from the water ligand. The ¹¹⁹Sn-NMR chemical shifts confirm that the Sn atom in triorganotin complexes is four-coordinate in CDCl₃ solution.     

Synclinic and anticlinic properties of (R,S) 4′-(1-methylheptyloxycarbonyl)biphenyl-4-yl 4-[7-(2,2,3,3,4,4,4-heptafluorobutoxy)heptyl-1-oxy]benzoates

Four racemic mixtures were synthesized and characterized. Their mesomorphic properties, such as phase transitions temperatures and enthalpies, were measured by a polarizing optical microscope and differential scanning calorimetry. The influence of one racemic mixture on the properties of the OAFLC mixture W-1000 was studied. The results show a wide temperature range of the SmC_A* phase in this new mixture. The helical pitch was measured by spectrophotometry method. The electro-optical properties of the mixture were also presented and discussed.     

1-(8-喹啉)-3-(2-苯并噻唑)三氮烯(QBTT)分光光度法测定微量钯(Ⅱ)

研究了新显色剂 1 - (8-喹啉 ) - 3- (2 -苯并噻唑 )三氮烯 (QBTT)分光光度法测定 Pd( )的条件。在 p H1 1 .0的 Na2 B4O7- Na OH缓冲介质 ,该试剂与 Pd( )形成摩尔比为 2∶ 1的绿色稳定络合物。其最大吸收波长在 6 40 nm处 ,表观摩尔吸光系数 ε为 7.85× 1 0 4L·mol-1 ·cm-1 ,Pd( )的浓度在 0— 1 .2 μg/ m L范围内符合朗伯 -比尔定律。对 30多种共存离子的影响实结果表明 ,大多数常见离子不干扰测定。方法具有较好的选择性 ,用其直接测定催化剂样品中的微量钯 ,结果满意     

Atomic and electronic properties of tert-butanol on the Si(001)-(2×1) surface

The atomic and electronic properties of the adsorption of tert-butanol [(CH₃)₃OH] molecule on the Si(001)-(2×1) surface have been studied by using the ab-initio density functional theory (DFT) based on pseudopotential approach. We have found that tert-butanol bonded the Si(001) surface by oxygen atom, cleaving a O–H bond and producing a Si-H bond and tert-butoxy surface species. We have also investigated the influence of chemisorption of tert-butanol on the electronic structure of the clean Si(001)-(2×1) surface. Two occupied surface states situated entirely below the bulk valence band maximum have been identified, which means that the clean Si(001)-(2×1)surface was passivated by the chemisorption of tert-butanol. In order to explain the nature of the surface components we have also plotted the total and partial charge densities at the [`(K)]\bar{K} point of the surface Brillouin zone (SBZ).     

First observation of the decays B(0) → D(+)K(-)π(+)π(-) and B(-) → D(0)K(-)π(+)π(-)

First observations of the Cabibbo-suppressed decays B(0) → D(+)K(-)π(+)π(-) and B(-) → D(0)K(-)π(+)π(-) are reported using 35 pb(-1) of data collected with the LHCb detector. Their branching fractions are measured with respect to the corresponding Cabibbo-favored decays, from which we obtain B(B(0) → D(+)K(-)π(+)π(-))/B(B(0) → D(+)π(-)π(+)π(-))=(5.9±1.1±0.5)×10(-2) and B(B(-) → D(0)K(-)π(+)π(-))/B(B(-) → D(0)π(-)π(+)π(-))=(9.4±1.3±0.9)×10(-2), where the uncertainties are statistical and systematic, respectively. The B(-) → D(0)K(-)π(+)π(-) decay is particularly interesting, as it can be used in a similar way to B(-) → D(0)K(-) to measure the Cabibbo-Kobayashi-Maskawa phase γ.     

The Rh(100)-(3 × 1)-2O structure

The O adsorption on Rh(100) has been studied using high resolution core level spectroscopy, low energy electron diffraction and scanning tunnelling microscopy. In addition to the well known (2 × 2), (2 × 2)-pg and c(8 × 2) structures at coverages of 0.25, 0.5 and 1.75 ML respectively, an intermediate (3 × 1) structure with a coverage of 2/3 ML is identified.     

Entanglement Conditions for Mixed SU(2) and SU(1, 1) Systems

We derive a class of inequalities for detecting entanglement in the mixed SU(2) and SU(1,?1) systems based on the Schrödinger-Robertson indeterminacy relations in conjugation with the partial transposition. These inequalities are in general stronger than those based on the usual Heisenberg uncertainty relations for detecting entanglement. Furthermore, based on the complete reduction from SU(2) and SU(1,?1) systems to bosonic systems, we derive some entanglement conditions for two-mode systems. We also use the partial reduction to obtain some inequalities in the mixed SU(2) (or SU(1,?1)) and bosonic systems.     

(Z)-1-溴-2-(对氯苯基)-1,2-双(对甲氧苯基)-乙烯晶体结构

题目化合物(C₂₂H₁₈O₂ClBr)为单斜晶系,空间群为(P2₁)/n,晶胞参数a=19.502(10)?,b=9.118(5)?,c=11.233(6)?;β=88.18(1)°。结构由MULTAN-80确定。首先在E图上确定了溴原子位置,由加权傅里叶综合定出了其余26个非氢原子坐标。原子坐标按各向同性和各向异性温度因子各修正两轮后,计算差值电子密度图,从差值图上找出了全部氢原子。氢原子坐标按各向同性和非氢原子按各 关键词：     

STM study of the Ni(110)-(2 × 1)-2CO system: structure and bonding-site determination

The structure of the Ni(110)-(2 × 1)-2CO system has been studied with scanning tunneling microscopy (STM) at room temperature. Contrary to many previous studies, it is found that atomically-resolved STM imaging of CO molecules is attainable. By comparing the apparent CO adlayer registry with coadsorbed low concentrations of O and S, it is found that the CO molecules bond in short-bridge sites along the Ni [11̄0] rows and alternately tilt away from the normal direction within the (001) plane.     

Depth and orientational dependencies of MRI T(2) and T(1ρ) sensitivities towards trypsin degradation and Gd-DTPA(2-) presence in articular cartilage at microscopic resolution

Depth and orientational dependencies of microscopic magnetic resonance imaging (MRI) T(2) and T(1ρ) sensitivities were studied in native and trypsin-degraded articular cartilage before and after being soaked in 1 mM Gd-DTPA(2-) solution. When the cartilage surface was perpendicular to B(0), a typical laminar appearance was visible in T(2)-weighted images but not in T(1ρ)-weighted images, especially when the spin-lock field was high (2 kHz). At the magic angle (55°) orientation, neither T(2)- nor T(1ρ)-weighted image had a laminar appearance. Trypsin degradation caused a depth- and orientational-dependent T(2) increase (4%-64%) and a more uniform T(1ρ) increase at a sufficiently high spin-lock field (55%-81%). The presence of the Gd ions caused both T(2) and T(1ρ) to decrease significantly in the degraded tissue (6%-38% and 44%-49%, respectively) but less notably in the native tissue (5%-10% and 16%-28%, respectively). A quantity Sensitivity was introduced that combined both the percentage change and the absolute change in the relaxation analysis. An MRI experimental protocol based on two T(1ρ) measurements (without and with the presence of the Gd ions) was proposed to be a new imaging marker for cartilage degradation.