Electronic and Structural Properties
Two-dimensional materials: electronic and structural properties of defective graphene and boron nitride from first principles
... investigate electronic and structural properties of graphene and boron nitride two-dimensional ...stability and elec- tronic properties of nine different models for ...
164
Electronic, Magnetic and Structural Properties of the Spin Liquid Candidate BaTi1/2Mn1/2O3
... GPS and LTF spectrometers of the Swiss Muon Source at the Paul Scherrer Institute (PSI) in Vil- ...(LTF) and 1.5 < T < 200 K (GPS) [25] in zero magnetic eld (ZF) and in longi- tudinal applied ...
81
Structural properties of nanoscopic ring systems and their optical response
... the electronic and structural properties of nanostructured systems were stud- ied aiming to get a realistic model for quantum rings, potentially adaptable for quantum ...wells, and ...
135
Stability and electronic properties of carbon nanotubes doped with transition metal impurities
... stability and electronic properties of zigzag carbon nanotubes doped with iron, nickel and manganese impurity ...the electronic and structural properties as a ...
6
High Pressure Structural Properties of Cerium Monopnictide
... chalcogenides and pnictide compounds, only CeP has been found to undergo a first order phase transition (isomorphous) at about 10 GPa ...theoretical and accurate experimental investigations of ...
4
Magnetic and structural properties Al-based alloys obtained by mechanical alloying
... temperatures and high ...space and ordination mode, intermediate between periodic phases and crystalline phases amorphous ...good structural, electronic and magnetic ...
82
Structural, electronic properties and elastic constants of ZnO.
... STRUCTURAL, ELECTRONIC PROPERTIES AND ELASTIC CONSTANTS OF ...The electronic, structural properties and elastic constants of the wurtzite phase of zinc oxide, ZnO, ...
8
Structural and Substructural Properties of the Zinc and Cadmium Chalcogenides Thin Films (a Review)
... development and application of the new semiconductor ...diodes and transistors were based on these materials ...diodes, and optical modulators, the III-VI compounds have found wide ...crystals ...
28
Structural, morphological and optical properties of Ca10V6O25
... the structural order/disorder provokes an electronic redistribution of energy levels in both the VB and CB; these redistributions induce a change in the band gap and influence the intrinsic ...
119
DFT calculations of the structural, electronic, optical and vibrational properties of anhydrous orthorhombic L-threonine crystals
... optical properties have been calculated considering [001] as the incidence direction of polarization of the incident ...infrared and Raman spectra of L-threonine, as well as the thermodynamic ...
28
Structural, electronic and transport properties of nanoscaled systems
... study electronic and transport properties in nano-scaled ...the electronic properties of a hexagonal island of boron nitrite (h- BN) embedded into graphene nanoribbons (GNRs) in both ...
94
Temperature dependence of structural and electronic properties of the spin-liquid candidate κ-(BEDT-TTF) 2Cu 2(CN) 3
... K and a progressively disordered state above 200 K is fully consistent with the anomalous behavior revealed by 1 H-NMR measurements be- tween 150 and 200 K ...
7
Structural and electronic effects of the C2’ substituent in 1,4–benzodiazepines
... C–H and C–Cl ...presence and absence of the fluorine atom, it appears that the C–F bond reverses the polarity of the carbon atom C2' making it quite electro‐ ...physicochemical properties of this ...
7
Stability and electronic properties of (Ge)x(BN)y monolayers
... the structural stability and electronic properties of a new class of two-dimensional materials, formed by Ge, B, and N atoms (see ...eB and NeN bonds [29] ...
8
Structural, electronic and transport properties of nanoscaled systems
... miniaturization and smaller dissipation of energy has led the electronics industry to face a quantum barrier for silicon technology applications ...for electronic device designs have emerged after the ...
94
Density functional theory calculation of the electronic structure of Ba0.5Sr0.5TiO3: Photoluminescent properties and structural disorder
... the electronic structure of ordered and deformed asymmetric models for Ba .... Electronic properties are analyzed and the relevance of the present theoretical and experimental ...
7
Structural and electronic properties of PbTio3: density functional theory applied to periodic models.
... STRUCTURAL AND ELECTRONIC PROPERTIES OF PbTiO 3 : DENSITY FUNCTIONAL THEORY APPLIED TO PERIODIC ...the structural and electronic properties of PbTiO 3 ...(PbO ...
9
Structural, electronic and optical properties of ilmenite and perovskite CdSnO3 from DFT calculations
... conductor, and Mizoguchi et al [ 2 ] suggests that n-doped perovskite CdSnO 3 must have a remarkable electron ...anisotropic and heavier than electron effective masses for both perovskite and ...
14
Investigation of Structural, Morphological, Magnetic Properties and Biomedical applications of Cu
... (VSM) and fourier transform infrared spectroscopy analysis ...Magnetic properties of the synthesized magnetic nanoparticles are studied by using ...magnetic properties such as coercivity, magnetic ...
10
Synthesis and characterization of Fe3O4@Ag core-shell: structural, morphological, and magnetic properties
... chemical and biological sensing [7] and photothermal therapy ...chemical and biological sensing due to the broad absorption in the optical region associated with localized surface plasmon ...
7