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991.
Toshiyuki Arakane Takafumi Sato Takenori Fujii 《Journal of Physics and Chemistry of Solids》2011,72(5):552-555
We have investigated three-dimensional electronic structure for NaxCoO2 (x=0.77 and 0.65) by high-resolution angle-resolved photoemission spectroscopy to study the origin of antiferromagnetic (AF) transition of highly doped NaxCoO2(x>0.75). The a1g large hole-like Fermi surface (FS) in x=0.77 shows distinct three-dimensionality along the kz direction, and a three-dimensional small electron pocket appears around Γ point, indicating strong inter-layer electronic correlation. On the other hand, x=0.65 sample does not show three-dimensional behavior. This result indicates that transition of FS as a function of band filling is closely related to the occurrence of the magnetic transition in highly doped NaxCoO2. 相似文献
992.
The electronic structure and the metal-insulator transition (MIT) of V2O3 are investigated in the framework of density functional theory and GGA+U. It is found that, both the insulating and metallic phases can be realized in rhombohedral structure by varying the on-site Coulomb interaction, and the MIT in V2O3 can take place without any structure phase transition. Our calculated energy gap (0.63 eV) agrees with experimental result very well. The metallic phase exhibits high spin (S=1) character, but it becomes S=1/2 in insulating phase. According to our analysis, the Mott-Hubbard and the charge-transfer induce the MIT together, and it supports the mechanism postulated by Tanaka (2002) [11]. 相似文献
993.
A.C. Galca V. StancuM.A. Husanu C. DragoiN.G. Gheorghe L. TrupinaM. Enculescu E. Vasile 《Applied Surface Science》2011,257(14):5938-5943
The paper presents the influence of pulsed laser deposition (PLD) parameters on the structural and optical properties of PZT thin films grown on platinum substrate. X-ray diffraction (XRD), spectroscopic ellipsometry (SE) and X-ray photoelectron spectroscopy (XPS) are used to determine the thin film properties. Scanning electron microscopy (SEM) and atomic force microscopy (AFM) are employed to get additional information. By changing the distance between target and substrate, different crystalline orientations of PZT are obtained. The thin film thickness and its roughness, as well as the refractive index are also influenced by the chosen distance. 相似文献
994.
995.
Pure TiO2 and nitrogen doped titanium dioxide (N-TiO2) thin films were prepared by sol-gel method through spin coating on soda lime glass substrates. TiCl4 and urea were used as Ti and N sources in the sol. XRD results showed nitrogen doping has retarded anatase to rutile phase transformation. The doping also leads to a decrease in roughness of the samples from 4 nm (TiO2) to 1 nm (N-TiO2). However, surface analysis by statistical methods reveals that both surfaces have self-affine structure. Optical band gap of thin films was shifted from 3.65 eV (TiO2) to 3.47 eV (N-TiO2). Hydrophilic conversion and photocatalytic degradation properties of thin films were investigated and exhibited that N-TiO2 thin film has more preferable hydrophilicity and photocatalytic properties under UV illumination. 相似文献
996.
Xinrui Miao Li XuChenyi Liao Zhuomin LiJian Zhou Wenli Deng 《Applied Surface Science》2011,257(10):4559-4565
Self-assembled monolayers of hexadecyl palmitate (HP) and 3,3′-thiodipropionic acid di-n-octadecyl ester (TADE) physisorbed on highly oriented pyrolytic graphite (HOPG) are investigated using scanning tunneling microscope (STM) and computer simulation. Both molecules form alkane-like linear shapes to maximize the interactions with substrate when they adsorb on HOPG surface. The HP molecules self-assemble into lamellae with the chain-trough angle of 48°, which is the result of a shifting 3/2 units from the adjacent molecule in a lamella. Based on the simulation insights combined with STM images, we confirm that a perpendicular orientation appears in which the HP molecular backbone is rotated 90° with respect to the substrate such that the carbonyl points away from the HOPG surface. TADE molecules form three kinds of configurations with chain-trough angles of 90°, 72° and 60° by shifting 0, 1/2 and 1 units from their adjacent molecules, respectively. The bright stripes in STM images reveal the electron density distribution of the part between two ester groups. The energy differences of three TADE adsorption configurations by molecular mechanics (MM) simulation are used to explain the structural coexistence phenomenon. It is also shown that lattice match between alkyl chain of molecules and HOPG substrate could change molecular conformation upon self-assembly. 相似文献
997.
B. HuB.Y. Man C. YangM. Liu C.S. ChenX.G. Gao S.C. XuC.C. Wang Z.C. Sun 《Applied Surface Science》2011,258(1):525-529
Mn-doped GaN films (Ga1−xMnxN) were grown on sapphire (0 0 0 1) using Laser assisted Molecular Beam Epitaxy (LMBE). High-quality nanocrystalline Ga1−xMnxN films with different Mn concentration were then obtained by thermal annealing treatment for 30 min in the ammonia atmosphere. Mn ions were incorporated into the wurtzite structure of the host lattice by substituting the Ga sites with Mn3+ due to the thermal treatment. Mn3+, which is confirmed by XPS analysis, is believed to be the decisive factor in the origin of room-temperature ferromagnetism. The better room-temperature ferromagnetism is given with the higher Mn3+ concentration. The bound magnetic polarons (BMP) theory can be used to prove our room-temperature ferromagnetic properties. The film with the maximum concentration of Mn3+ presents strongest ferromagnetic signal at annealing temperature 950 °C. Higher annealing temperature (such as 1150 °C) is not proper because of the second phase MnxGay formation. 相似文献
998.
Himanshu Srivastava Pragya TiwariA.K. Srivastava Sanjay RaiTapas Ganguli S.K. Deb 《Applied Surface Science》2011,258(1):494-500
The effect of texture of iron foil substrate on the growth of hematite nanowires by annealing method has been investigated in detail. Three substrates of different textures were prepared from a [2 0 0] oriented iron foil by some simple processes. The hematite nanowires on these substrates were synthesized by annealing iron foil at 700 °C in moist oxygen. The growth pattern of nanowires on these substrates showed that the growth of hematite nanowires depends strongly on the iron substrate texture and [1 1 0] oriented iron grains are necessary for their growth. The samples were characterized by Scanning Electron Microscope (SEM), Transmission Electron Microscope (TEM), X-ray diffraction (XRD), Electron Back Scatter Diffraction (EBSD) and Raman Spectroscopy. We have also tried to explain the various observations on the mechanism of growth. Mainly, the presence of water vapor significantly enhanced the formation of hematite nanowires which resulted in a very dense and aligned growth of nanowires on the substrate areas of favorable texture. Finally, the study proved the substrate texture to be a powerful tool to control growth of nanowires and can be used efficiently for patterning and large scale synthesis of the nanowires. 相似文献
999.
Junko Morikawa Akihiro OrieYuta Hikima Toshimasa HashimotoSaulius Juodkazis 《Applied Surface Science》2011,257(12):5439-5442
Changes of thermal diffusivity inside femtosecond laser-structured volumes as small as few percent were reliably determined (with standard deviation less than 1%) with miniaturized sensors. An increase of thermal diffusivity of a crystalline high-density polyethylene (HDPE) inflation films by 10-20% from the measured (1.16 ± 0.01) × 10−7 m2 s−1 value in regions not structured by femtosecond laser pulses is considerably larger than that of non-crystalline polymers, 0-3%. The origin of the change of thermal diffusivity are interplay between the laser induced disordering, voids’ formation, compaction, and changes in molecular orientation. It is shown that laser structuring can be used to modify thermal and optical properties. The birefringence and infrared spectroscopy with thermal imaging of CH2 vibrations are confirming inter-relation between structural, optical, and thermal properties of the laser-structured crystalline HDPE inflation films. Birefringence modulation as high as Δn ∼ ± 1 × 10−3 is achieved with grating structures. 相似文献
1000.
Direct metal deposition (DMD) with coaxial powder injection allows fabrication of three-dimensional geometry with rapidly solidified microstructure. During DMD, addition of powder leads to the interaction between laser and powder, and also the redistribution of solute. The concentration distribution of the alloying element is very important for mechanical properties of the deposited clad material. The evolution of concentration distribution of carbon and chromium in the molten pool is simulated using a self-consistent three-dimensional model, based on the solution of the equations of mass, momentum, energy conservation and solute transport in the molten pool. The experimental and calculated molten pool geometry is compared for model validation purposes. 相似文献