Materials Literature
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The overall signal-to-noise ratio per unit dose for X-ray diffraction data from protein crystals can be improved by reducing the mass and density of all material surrounding the crystals. This article demonstrates a path towards the practical ultimate in background reduction by use of atomically thin graphene sheets a…
We report an angle-resolved photoemission spectroscopy (ARPES) study on IrTe2 which exhibits an interesting lattice distortion below 270 K and becomes triangular lattice superconductors by suppressing the distortion via chemical substitution or intercalation. ARPES results at 300 K show multi-band Fermi surfaces with…
In this feature article, the grafting of hyperbranched polymers to different substrates is reviewed. Both grafting onto macromolecules with different topologies (homogeneous grafting) and the resulting complex polymer architectures containing highly branched segments as well as their applications are discussed. In the…
Molecular mechanisms of the steady-state growth of the chain folded lamella and the cold crystallization across the glass transition temperature Tg are investigated by molecular dynamics simulation for a system of long polyethylene (PE)-like polymers made of 512 united atoms C512. The present paper aims to reconsider…
ABSTRACT Amine‐cured epoxy resins were prepared at 2% by weight phosphorus content using four halogen‐free flame retardants; poly(m‐phenylene methyl phosphonate) (Fyrol PMP); 9,10‐dihydro‐9‐oxa‐10‐phosphaphenanthrene‐10‐oxide; red phosphorus; and aluminum diethylphosphinate (OP1230). The effect of these additives on t…
Graphite-nanoplatelet (GNP)-decorated polymer nanofiber composites with hierarchical structures were fabricated by the combination of electrospinning and ultrasonication. It was found that GNPs could be well attached or embedded onto the nanofibers when their size was comparable to the nanofiber diameter. X-ray diffra…
Creating cool fusion: The oxidative fusion of meso-(diarylamino)porphyrins depends heavily on the structures of the diarylamino groups. Bridged diarylamino groups result in the oxidative fusion of 3,5-di-tert-butylphenyl groups to the porphyrin moiety (blue), while non-bridged diarylamino groups invoke formation of ni…
The photomechanical bending behavior of chiral crystals composed of S- and R-enantiomers of photochromic N -3,5-di- tert -butylsalicylidene-1-phenylethylamine in enol form [enol-( S )- 1 and enol-( R )- 1 ] has been compared with that of achiral crystals of the racemic compound [enol-( rac )- 1 ] of S- and R-enantiome…
Natural gas is catalytically converted into several bulk chemicals such as ammonia, methanol, dimethyl ether, and synthetic liquid fuels by Fischer-Tropsch synthesis and similar processes. The main step in the conversion of natural gas to these products is the production of synthesis gas with the desired composition r…
The band offsets between the Zn-IV-N${}_{2}$ nitrides, ZnGeN${}_{2}$ and ZnSnN${}_{2}$, and two other closely lattice matched semiconductors, ZnO and GaN, are calculated using density functional theory calculations including quasiparticle corrections. The interface dependence as well as the role of strain are investig…
We report on a combined scanning tunneling microscopy and density functional theory calculation study of the SrTiO(3) (110)-(4 × 1) surface. It is found that antiphase domains are formed along the [11[over ¯]0]-oriented stripes on the surface. The domain boundaries are decorated by defect pairs consisting of Ti(2)O(3)…
The temperature dependence of optical constants of titanium nitride thin film is investigated using spectroscopic ellipsometry between 1.4 to 5 eV in the temperature range 300 K to 650 K in steps of 50 K. The real and imaginary parts of the dielectric functions "1(E) and "2(E) increase marginally with increase in temp…
Weighted least squares fitting to a database of quantum mechanical calculations can determine the optimal parameters of empirical potential models. While algorithms exist to provide optimal potential parameters for a given fitting database of structures and their structure property functions, and to estimate predictio…
Development of topological insulating phases in IV-VI compounds under dynamic lattice deformations is studied using first-principles methods. Unlike the static state of topological phases at equilibrium conditions, we show that non-trivial topological phases are induced in the compounds by the dynamic lattice deformat…
Temperature and PtCo composition dependence of exchange bias in PtxCo1-x/CoO bilayers is investigated. It is observed that exchange bias properties, blocking temperature and magnetic anisotropy of the PtxCo1-x/CoO thin films are strongly affected by the concentration of Pt at the common interface. A detailed structura…
The Liouville-Lanczos approach to linear-response time-dependent density-functional theory is generalized so as to encompass electron energy loss and inelastic x-ray scattering spectroscopies in periodic solids. The computation of virtual orbitals and the manipulation of large matrices are avoided by adopting a repres…
We grew highly textured phase pure VO2 thin films on c-plane Al2O3 substrates with different oxygen partial pressure. X-ray absorption and photoemission spectroscopy confirm the identical valence state of vanadium ions despite the different oxygen pressure during the deposition. As the O2 flow rate increases, the [010…
Collagen is the most abundant protein in the extracellular matrix (ECM), where its structural organization conveys mechanical information to cells. Using optical-tweezers-based microrheology, we investigated mechanical properties both of collagen molecules at a range of concentrations in acidic solution where fibrils…
Electronic energy loss of hydrogen ions in HfO2 was investigated in a wide energy range in the medium and low energy ion scattering regime. Experiments by Time-Of-Flight Medium-Energy Ion Scattering (TOF-MEIS) with proton and deuteron projectiles were performed in backscattering geometry for nm-films of HfO2 on Si wit…
A detailed investigation of the formation and properties of mesoporous silica templated by the chiral nematic liquid crystal phase of cellulose nanocrystals (CNCs) is presented. Under appropriate conditions, CNCs co‐assemble with silica up to loadings of ≈60 wt% to give composite films with periodic chiral nanostructu…