Materials Literature
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We have studied the interaction of ethanol with reduced TiO(2)(110)-(1 × 1) by high-resolution scanning tunneling microscopy (STM) measurements and density functional theory calculations. The STM data revealed direct evidence for the coexistence of molecularly and dissociatively adsorbed ethanol species on surface Ti…
The influence of both compressive and tensile epitaxial strain along with the electrical boundary conditions on the ferroelastic and ferroelectric domain patterns of bismuth ferrite films was studied. BiFeO${}_{3}$ films were grown on SrTiO${}_{3}$(001), DyScO${}_{3}$(110), GdScO${}_{3}$(110), and SmScO${}_{3}$(110) s…
Abstract Metamaterials are engineered composite materials offering unprecedented control of wave propagation. Despite their complexity, effective properties can frequently be extracted by conceptualizing them as homogeneous and isotropic media with dispersive electric permittivity and magnetic permeability. For an ide…
An unprecedented single-side trisalkoxo-substituted Anderson-type polyoxometalate (POM) was synthesized (see scheme). As confirmed by single-crystal X-ray diffraction and IR analyses, the single-side-functionalized Anderson-type POM forms interesting supramolecular assemblies, including dimers and 1D chains.
We present a study of the stability of n-vacancies (V (n)) and hydrogens in the hexagonal close-packed titanium system computed by means of first-principles calculations. In this work, performed by using the generalized gradient approximation of density functional theory, we focused on the formation energies and the p…
Inhibitors are added to concrete to improve its quality and integrity. In recent years the use of these inhibitors in producing high performance concrete has increased significantly as a result of aggressive environment. This report is based on the corrosion inhibitors used in concrete and also on the published litera…
Abstract We report a new strategy to achieve triple shape memory properties by using side‐chain liquid crystalline (SCLC) type random terpolymer networks (XL‐ TP‐ n ), where n is the length of flexible methylene spacer ( n = 5, 10, and 15) to link backbone and mesogen. A lower glass transition temperature ( T g = T lo…
Abstract Review: 100 refs.
Twin relationships and stress-induced reorientation were studied in Ni2Mn1.14Ga0.86 single crystal with five-layered modulated martensite crystal structure. Very low twinning stress of about 0.1 MPa was found for twin boundaries which deviated a few degrees from the (011¯) crystallographic plane. However, twin boundar…
Hexagonal orthoferrites of rare earths RFeO3 (R = Lu, Er-Tb) were grown epitaxially on (111)ZrO2(Y2O3) substrates using metal-organic chemical vapour deposition. Temperature and field dependences of magnetization were measured and analyzed for all samples and revealed weak ferromagnetic behavior below T = 120–140 K. T…
It has recently been observed that a mixture of two enantiomeric crystals subjected to attrition in a solution containing a racemizing agent undergoes symmetry breaking, with only one of the enantiomers eventually remaining in solid form. This process is believed to occur due to the interplay between racemization in s…
In this paper, Polyimide/Montmorillonite Nanocomposites (PI/MMT NCs), based on aromatic diamine (4-Aminophenyl sulfone) (APS) and aromatic dianhydride (3,3',4,4'-benzophenonetetracarboxylic dianhydride) (BTDA) were prepared using in situ polymerization and solution-dispersion techniques. The prepared PI/MMT NCs films…
Graphitic nanowiggles (GNWs) are periodic repetitions of nonaligned finite-sized graphitic nanoribbon domains seamlessly stitched together without structural defects. These complex nanostructures have been recently fabricated [Cai et al., Nature (London) 466, 470 (2010)] and are here predicted to possess unusual prope…
A new series of neutral oxamato-bridged M(II)Cu(II) chiral chains of general formula [MCuL(x)(S)(m)(H(2)O)(n)]·aS·bH(2)O [L(1)=(M)-1,1'-binaphthalene-2,2'-bis(oxamate) with M=Mn (1a) and Co (1b); L(2)=(P)-1,1'-binaphthalene-2,2'-bis(oxamate) with M=Mn (2a) and Co (2b)] and the analogous racemic chains of formula [MCuL…
The measurement of spatially resolved high doses in microbeam radiation therapy has always been a challenging task, where a combination of high dose response and high spatial resolution (microns) is required for synchrotron radiation peaked around 50 keV. The x-ray induced Sm3+ → Sm2+ valence conversion in Sm3+ doped…
Bi2S3 nanocrystals are employed in a polymer/nanocrystal solar cell as a non-toxic inorganic electron acceptor with a high absorption coefficient and a bandgap of 1.3 eV optimal for single-junction solar harnessing. The reported solar cell yields a power conversion efficiency of 0.46% in a bilayer structure and shows…
Manganese-doped zinc sulfide quantum dots (Mn:ZnS d-dots) with high optical quality, pure dopant emission of 55-65% photoluminescence quantum yield, were synthesized in octadecene media with generic starting materials, namely, zinc (manganese) carboxylic acid salts, S powder, and dodecanethiol (DDT) based on a "nuclea…
Boron, discovered as an element in 1808 and produced in pure form in 1909, has still remained the last elemental material, having stable natural isotopes, with the ground state crystal phase to be unknown. It has been a subject of long-standing controversy, if α-B or β-B is the thermodynamically stable phase at ambien…
First-principles density functional theory oxygen chemical shift tensors were calculated for A(B,B')O(3) perovskite alloys Pb(Zr(1/2)Ti(1/2))O(3) (PZT) and Pb(Mg(1/3)Nb(2/3))O(3) (PMN). Quantum chemistry methods for embedded clusters and the gauge including projector augmented waves (GIPAW) method [C. J. Pickard and F…
Large size bismuth telluride based polycrystalline alloys have been prepared to investigate the texture-related anisotropy of thermoelectric properties. X-ray diffraction analysis indicated that the n-type alloy was more easily (001) oriented than the p-type one. Both the electrical and thermal conductivities showed s…