Electronic and Magnetic Properties of Double Perovskite Ca2CrSbO6

First-principles calculations have been performed for the study of the electronic band structure and ferromagnetic properties of double perovskite Ca2CrSbO6. The density of states, total energy, spin magnetic moment, and charge density were calculated and analyzed in details. It is found that Ca2CrSbO6 has a stable ferromagnetic ground state and the spin magnetic moment per molecule is about 2.99#B. The chromium contributes the most in the total magnetic moments. The results indicate that Ca2CrSbO6 is half-metallic.     

用于指导仲氢诱导核极化状态保存的己烯分子中五自旋的单重态制备和寿命研究

仲氢诱导核极化（PHIP）技术能极大地增强核磁共振（NMR）信号的灵敏度,已被应用于磁共振成像、原位化学反应监测等领域．除了不断提高不同分子极化后的灵敏度外,延长和保存高极化度状态对PHIP技术的应用也至关重要,其中将极化后的状态制备成核自旋单重态是目前被研究较多的一种方法．本文以能被PHIP技术极化的己烯分子为研究对象,通过设计优化控制脉冲,对分子中的一个五自旋体系进行操控,制备了多种核自旋单重态,结果表明：己烯分子的碳-碳双键上存在三种不同的核自旋单重态,它们的寿命均长于仲氢极化后产生的初始态的寿命,可以作为延缓极化度衰减的一种中间态;通过对比单重态的寿命与相应自旋的纵向弛豫时间发现,将极化后己烯的状态转化为纵向磁化可能也是一种保存极化度的有效方法．     

Collective spin excitations in 2D paramagnet with dipole interaction

The collective spin excitations in the unbounded 2D paramagnetic system with dipole interactions are studied. The model Hamiltonian includes Zeeman energy and dipole interaction energy, while the exchange vanishes. The system is placed into a constant uniform magnetic field which is orthogonal to the lattice plane. It provides the equilibrium state with spin ordering along the field direction, and the saturation is reached at zero temperature. We consider the deviations of spin magnetic moments from its equilibrium position along the external field. The Holstein-Primakoff representation is applied to spin operators in low-temperature approximation. When the interaction between the spin waves is negligible and only two-magnon terms are taken into account, the Hamiltonian diagonalisation is possible. We obtain the dispersion relation for spin waves in the square and hexagonal honeycomb lattice. Bose-Einstein statistics determine the average number of spin deviations, and total system magnetization. The lattice structure does not influence on magnetization at the long-wavelength limit. The dependencies of the relative magnetization and longitudinal susceptibility on temperature and external field intensity are found. The internal energy and specific heat of the Bose gas of spin waves are calculated. The collective spin excitations play a significant role in the properties of the paramagnetic system at low temperature and strong external magnetic field.     

Circularly polarized X-rays probing nuclear magnetic moments and magnetism of solids

It is demonstrated how circularly polarized x-rays can be used in nuclear and solid state physics. Detection of the radiation pattern of circularly polarized x-rays emitted in highly converted decays of oriented radio isotopes allows the determination of nuclear magnetic moments. Studying the absorption profiles of energy-tunable intense circularly polarized x-rays emitted from high-energy electron storage rings provides a powerful method to determine spin structure of electronic states, local magnetic moments and magnetic short range order in ferromagnetic materials.     

Microwave Spin Frequency Comb Memory Protocol Controlled by Gradient Magnetic Pulses

We have demonstrated a combination of frequency comb spin-echo protocol in a conventional microwave pulsed electron spin resonance spectrometer with gradient pulses of the external magnetic field applied for on-demand retrieval of signal microwave pulses at the required moments of time. A natural high-finesse periodic structure was used as a carrier of stored information. The structure is made out of hyperfine lines of electron spin resonance of tetracyanoethylene anion radicals in toluene at room temperature. Herein, we have also observed that using the pulses of gradient magnetic field can increase the memory capacity. The experimental results demonstrated promising opportunities for controlling electron nuclear spin coherence, which could be useful for implementation of broadband microwave or optical-microwave noise free quantum memory protocols.     

Spectrum of an electron spin coupled to an unpolarized bath of nuclear spins

The main source of decoherence for an electron spin confined to a quantum dot is the hyperfine interaction with nuclear spins. To analyze this process theoretically we diagonalize the central spin Hamiltonian in the high magnetic B-field limit. Then we project the eigenstates onto an unpolarized state of the nuclear bath and find that the resulting density of states has Gaussian tails. The level spacing of the nuclear sublevels is exponentially small in the middle of each of the two electron Zeeman levels but increases superexponentially away from the center. This suggests to select states from the wings of the distribution when the system is projected on a single eigenstate by a measurement to reduce the noise of the nuclear spin bath. This theory is valid when the external magnetic field is larger than a typical Overhauser field at high nuclear spin temperature.     

Chemisorption of Li and Na on iridium surfaces: An investigation with nuclear spin polarized atoms

The chemisorption of Li and Na on clean and oxygen covered polycrystalline iridium was investigated using nuclear spin polarized alkali atoms. During adsorption on the surface the moments of the nuclei act as microscopic probes. The nuclear quadrupole moments of the alkali atoms are interacting with the electric field gradient. The interaction reflects the charge distribution around the nucleus. The nuclear magnetic moments are interacting with magnetic fields generated by the magnetic moments of electrons.     

Quantum antiferromagnetism in quasicrystals

The antiferromagnetic Heisenberg model is studied on a two-dimensional bipartite quasiperiodic lattice. Using the stochastic series expansion quantum Monte Carlo method, the distribution of local staggered magnetic moments is determined on finite square approximants with up to 1393 sites, and a nontrivial inhomogeneous ground state is found. A hierarchical structure in the values of the moments is observed which arises from the self-similarity of the quasiperiodic lattice. The computed spin structure factor shows antiferromagnetic modulations that can be measured in neutron scattering and nuclear magnetic resonance experiments. This generic model is a first step towards understanding magnetic quasicrystals such as the recently discovered Zn-Mg-Ho icosahedral structure.     

Motion of neutral fermions with anomalous magnetic and electric moments in external fields

A covariant spin operator is found for fermions with anomalous magnetic and electric dipole moments in constant external fields. The spin behavior of a neutral fermion in constant magnetic and electric fields is investigated using exact solutions obtained for the Dirac equation.     

Voltage-selective bidirectional polarization and coherent rotation of nuclear spins in quantum dots

We propose and demonstrate that the nuclear spins of the host lattice in GaAs double quantum dots can be polarized in either of two opposite directions, parallel or antiparallel to an external magnetic field. The direction is selected by adjusting the dc voltage. This nuclear polarization manifests itself by repeated controlled electron-nuclear spin scattering in the Pauli spin-blockade state. Polarized nuclei are also controlled by means of nuclear magnetic resonance. This Letter confirms that the nuclear spins in quantum dots are long-lived quantum states with a coherence time of up to 1 ms, and may be a promising resource for quantum-information processing such as quantum memories for electron spin qubits.     

Spin and orbital magnetic moments of free nanoparticles

The determination of spin and orbital magnetic moments from the free atom to the bulk phase is an intriguing challenge for nanoscience, in particular, since most magnetic recording materials are based on nanostructures. We present temperature-dependent x-ray magnetic circular dichroism measurements of free Co clusters (N=8-22) from which the intrinsic spin and orbital magnetic moments of noninteracting magnetic nanoparticles have been deduced. An exceptionally strong enhancement of the orbital moment is verified for free magnetic clusters which is 4-6 times larger than the bulk value. Our temperature-dependent measurements reveal that the spin orientation along the external magnetic field is nearly saturated at ~20 K and 7 T, while the orbital orientation is clearly not.     

The effects of electron–phonon interaction on anisotropic RKKY interaction in graphene nanoribbon

We study the Ruderman–Kittle–Kasuya–Yosida (RKKY) interaction in doped armchair graphene nanoribbon. The effects of both external magnetic field and electron-Holstein phonon on RKKY interaction have been addressed. RKKY interaction as a function of distance between localized moments has been analyzed. It has been shown that a magnetic field along the z-axis mediates an anisotropic interaction which corresponds to a XXZ model interaction between two magnetic moments. In order to calculate the exchange interaction along arbitrary direction between two magnetic moments, we should obtain both transverse and longitudinal static spin susceptibilities of armchair graphene nanoribbon in the presence of electron-phonon coupling and magnetic field. The spin susceptibility components are calculated using the spin dependent Green’s function approach for Holstein model Hamiltonian. The effects of spin polarization on the dependence of exchange interaction on distance between moments are investigated via calculating correlation function of spin density operators. Our results show the influences of magnetic field on the spatial behavior of in-plane and longitudinal RKKY interactions are different in the presence of magnetic field.     

The electronic structure and the ferromagnetic properties of the organic radical 4-methacryloyloxy-2,2,6,6-tetramethyl-1-piperidinyloxyl (MOTMP)

The ab initio method of the full potential linearized augmented-plane-wave has been used to study the electronic band structure and the ferromagnetic (FM) properties of the organic radical MOTMP. The total and the partial density of states and the atomic spin magnetic moments are calculated. The calculation revealed that MOTMP has a stable ferromagnetic ground state and the spin magnetic moment is 1.0 μ_B per molecule, which is in good agreement with the experimental value. It is found that the unpaired electrons in this compound are localized in a molecular orbital constituted primarily of π*(NO) orbital and the main contribution of the spin magnetic moment comes from the NO free radical. It is also found that there exists ferromagnetic intermolecular interaction in the compound.     

Staggered potential and spin polarization effects on RKKY interaction in armchair graphene nanoribbon

Indirect exchange interaction between two magnetic external atoms, named by Ruderman–Kittle–Kasuya–Yosida (RKKY) interaction, has been presented in the staggered armchair graphene nanoribbon. We have studied RKKY interaction as a function of distance between localized moments. It has been shown that a magnetic ordering along the z-axis mediates an anisotropic interaction which corresponds to a XXZ model interaction between two magnetic moments. The static spin susceptibility components of armchair graphene nanoribbon have been calculated to find exchange interaction between arbitrary components of magnetic moments. We have exploited Green’s function approach in order to calculate spin susceptibility components of electronic gas in nanoribbon structure in the context of tight binding model Hamiltonian. The effects of parameter and ribbon width on the dependence of exchange interaction on distance between moments are investigated. Our results show the spin polarization along perpendicular to the plane leads to anisotropic behavior for exchange interaction between the two magnetic moments. In other words the spatial behavior of RKKY interaction between longitudinal components of magnetic moments is different from that of transverse components.     

Rotational parity and separation of water molecules into spin isomers

A theoretical explanation is proposed for the effect of variations in concentration of water molecule spin isomers in the gas phase during the interaction of molecules with a solid adsorbent surface. The explanation is based on antisymmetric (AS) correlation between proton spin moments and molecule rotation. A new AS correlation occurs during the interaction of the molecule with a dc electric field near the surface. Due to the new (external) AS correlation, ortho-and parawater molecules are formed; separation into spin modifications occurs over degenerate states of each rotational level of the molecule. Water molecule separation into spin modifications at the previous (internal) AS correlation occurs over rotational levels of molecules. The ratio of ortho-and parawater concentrations in the gas phase at the external AS correlation is compared with experimental data on chromatographic separation of water spin isomers. Quantitative agreement is observed between the calculated ratio and the ratio measured for water molecules at the final separation stage.     

Effective gyromagnetic ratios in a mixture of noble gases with artificial nuclear magnetization

The precession of nuclear magnetic moments for a noble gas in an external magnetic field upon the laser pumping of nuclear magnetization is considered. A shift of the nuclear magnetic resonance for a mixture of noble gases with different gyromagnetic ratios of nuclei is observed.     

Investigation of the Leggett-Garg inequality for precessing nuclear spins

We report experimental implementation of a protocol for testing the Leggett-Garg inequality (LGI) for nuclear spins precessing in an external magnetic field. The implementation involves certain controlled operations, performed in parallel on pairs of spin-1/2 nuclei (target and probe) from molecules of a nuclear magnetic resonance ensemble, which enable evaluation of temporal correlations from an LG string. Our experiment demonstrates violation of the LGI for time intervals between successive measurements, over which the effects of relaxation on the quantum state of target spin are negligible. Further, it is observed that the temporal correlations decay, and the same target spin appears to display macrorealistic behavior consistent with LGI.     

Electromagnetic moments of unstable nuclei studied with polarized projectile fragments

Phenomenon of ejectile spin polarization in the projectile fragmentation reaction was exploited as a tool to produce polarized radioactive nuclei. The polarized unstable nuclei were subjected to the β-detected NMR meaurements, and the magnetic moments and electric quadrupole moments were determined for several neutron-rich light nuclei. The comparison of the experimental results with theoretical predictions shows that the nuclear moments provide useful test of models for nuclear structure and interaction in the region of light-mass unstable nuclei.     

Stability of the spontaneous quantum Hall state in the triangular Kondo-lattice model

We study the behavior of the quarter-filled Kondo-lattice model on a triangular lattice by combining a zero-temperature variational approach and finite-temperature Monte Carlo simulations. For intermediate coupling between itinerant electrons and classical moments S(j), we find a thermodynamic phase transition into an exotic spin ordering with uniform scalar spin chirality and (S(j))=0. The state exhibits a spontaneous quantum Hall effect. We also study how its properties are affected by the application of an external magnetic field.