Materials Literature
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In this paper we present an accurate numerical scheme for extracting interatomic exchange parameters (${J}_{ij}$) of strongly correlated systems, based on first-principles full-potential electronic structure theory. The electronic structure is modeled with the help of a full-potential linear muffin-tin orbital method.…
Characteristics of zeolite formation, such as being kinetically slow and thermodynamically metastable, are the main bottlenecks that obstruct a fast zeolite synthesis. We present an ultrafast route, the first of its kind, to synthesize high-silica zeolite SSZ-13 in 10 min, instead of the several days usually required.…
In the present work, type I, II, and III heterostructures are constructed with the same base material using three representative functionalized monolayer scandium carbides (Sc2CF2, Sc2C(OH)2, and Sc2CO2) by first-principles calculations based on density functional theory. In contrast to general bilayer heterosystems c…
We calculate conductance and noise for quantum transport at the nodal point for arbitrarily tilted and anisotropic Dirac or Weyl cones. Tilted and anisotropic dispersions are generic in the absence of certain discrete symmetries, such as particle-hole and lattice point group symmetries. Whereas anisotropy affects the…
Bulk-like molybdenum disulfide (MoS2) thin films were deposited on the surface of p-type Si substrates using dc magnetron sputtering technique and MoS2/Si p-n junctions were formed. The vibrating modes of E12g and A1g were observed from the Raman spectrum of the MoS2 films. The current density versus voltage (J-V) cha…
Directing the supramolecular polymerization towards a preferred type of organization is extremely important in the design of functional soft materials. Proposed herein is a simple methodology to tune the length and optical chirality of supramolecular polymers formed from a chiral bichromophoric binaphthalene by the co…
Magnetic composites consisting of magnetite (Fe3O4), graphene oxide (GO), and Mg3Al-OH layered double hydroxide (LDH), denoted as MGL composites, with varying GO contents (RGO) were synthesized by a mechano-hydrothermal (MHT) route using Fe3O4, Mg(OH)2, and Al(OH)3 as the inorganic starting materials. The application…
A series of electrochromic metal complex nanosheets comprising 1,3,5-tris(4-(2,2':6',2″-terpyridyl)phenyl)benzene or 1,3,5-tris((2,2':6',2″-terpyridyl)ethynyl)benzene and Fe(2+) or Co(2+) was synthesized. The preparation of multilayered nanosheets was achieved by liquid/liquid interfacial synthesis using an organic li…
Owing to their long phonon mean free paths (MFPs) and high thermal conductivity, carbon nanotubes (CNTs) are ideal candidates for, e.g., removing heat from electronic devices. It is unknown, however, how the intrinsic phonon MFPs depend on vibrational frequency in nonequilibrium. We determine the spectrally resolved p…
Three-dimensional (3D) graphene aerogels (GA) show promise for applications in supercapacitors, electrode materials, gas sensors, and oil absorption due to their high porosity, mechanical strength, and electrical conductivity. However, the control, actuation, and response properties of graphene aerogels have not been…
We design, fabricate, and experimentally demonstrate an ultrathin, broadband half-wave plate in the near-infrared range using a plasmonic metasurface. The simulated results show that the linear polarization conversion efficiency is over 97% with over 90% reflectance across an 800 nm bandwidth. Moreover, simulated and…
Understanding nanoparticle-protein interactions is a crucial issue in the development of targeted nanomaterial delivery. Besides unraveling the composition of the nanoparticle's protein coronas, distinct proteins thereof could control nanoparticle uptake into specific cell types. Here we differentially analyzed the pr…
Radar-absorbing materials are used in stealth technologies for concealment of an object from radar detection. Resistive and/or magnetic composite materials are used to reduce the backscattered microwave signals. Inability to control electrical properties of these materials, however, hinders the realization of active c…
A collaboration of researchers from Japan and France present a comprehensive study of phonon lifetimes and thermal conductivity for 33 zincblende- and wurtzite compounds using linearized phonon Boltzmann equation and first-principles anharmonic phonon calculations. The software that the authors created for this study…
ADVERTISEMENT RETURN TO ISSUEPREVReviewNEXTPotassium–Sodium Niobate Lead-Free Piezoelectric Materials: Past, Present, and Future of Phase BoundariesJiagang Wu*, Dingquan Xiao, and Jianguo ZhuView Author Information Department of Materials Science, Sichuan University, Chengdu 610064, China*E-mail:[email protected] and…
Objective: The aim of this study is to synthesis silver nanoparticles using C arica papaya leaf extracts and testing its antibacterial activity. Methods: Silver nanoparticles (Agnps) were prepared by treating Carica papaya leaf extracts with 1 mm silver nitrate (AgNO 3 ). The bioreduced silver nanoparticles were chara…
Coherent extreme ultraviolet beams from tabletop high harmonic generation offer several revolutionary capabilities for observing nanoscale systems on their intrinsic length and time scales. By launching and monitoring hypersonic acoustic waves in such systems, we characterize the mechanical properties of sub-10nm laye…
A Monte Carlo electron scattering simulation tool that can create SEM images of 3D features with arbitrary geometry has been developed. This is combined with both a stochastic resist model and synthetic 3D features to probe the effect of the effect of roughness on SEM measurements. Sidewall roughness makes it difficul…
Interaction-induced electric dipole moment, polarisability and first hyperpolarisability are investigated in model hydrogen-bonded clusters built of hydrogen fluoride molecules organised in three linear chains parallel to each other. The properties are evaluated within the finite field approach, using the second order…
To demonstrate the possibility of using EBID masks for sub-10 nm pattern transfer into silicon, first experiments were carried out by using 20-40 nm EBID masks, that were etched by different chemistries. It is experimentally verified that recipes based on hydrogen bromide, chlorine and boron trichloride can selectivel…