Structures, and Thermophysical Properties Characterizations of (La1-xHox)3NbO7 Solid Solutions as Thermal Barrier Coatings

A sequence of (La1-xHox)3NbO7 solid solutions were fabricated in this work, which were studied as candidate for thermal insulation materials. The lattices were identified via XRD, when SEM and EDS were used to characterize the microstructures and element distributions. The results showed that the highest modulus, hardness, and toughness of (La1-xHox)3NbO7 were 196 GPa, 9.2 GPa, and 1.6 MPa m1/2, respectively, and they accorded with the mechanical property requirements. Also, a low thermal conductivity (1.06 W m−1 K−1) and high thermal expansion coefficients (TECs: 11.3 × 10−6 K−1) were simultaneously realized in (La3/6Ho3/6)3NbO7, at high temperatures. No phase transition was detected up to 1,200°C, which proved their good high-temperature lattice stability. The intense anharmonic lattice vibrations might contribute to the outstanding thermal properties of (La1-xHox)3NbO7 ceramics. The suitable modulus, high hardness, low thermal conductivity, and high TECs of (La1-xHox)3NbO7 solid solutions proclaimed that they were exceptional thermal insulation ceramics.

Effect of Ni on Microstructure and Mechanical Property of a Co-Ti-V-Based Superalloy

The effect of Ni on microstructure, elemental partition behavior, γ ′ phase solvus temperature, lattice misfit between γ and γ ′ phases, and mechanical properties of the Co-8Ti-11V-xNi alloys was investigated. The result shows that the lattice misfit in the alloys decreases from 0.74% to 0.61% as the Ni content increases from 0 to 10%, and the average sizes of the cuboidal γ ′ phase were measured to be 312.10 nm, 112.86 nm, and 141.84 nm for the Co-8Ti-11V, Co-8Ti-11V-5Ni, and Co-8Ti-11V-10Ni, respectively. Ti, V, and Ni exhibit a slight tendency to partition into the γ ′ phase, while Co shows a slight tendency to partition into the γ phase. The solvus temperatures of the γ ′ phase were measured to be 1167°C, 1114°C, and 1108°C for the Co-8Ti-11V, Co-8Ti-11V-5Ni, and Co-8Ti-11V-10Ni alloys, respectively, by using differential scanning calorimetry (DSC). Moreover, the yield strength and ultimate strength of the Co-8Ti-11V, Co-8Ti-11V-5Ni, and Co-8Ti-11V-10Ni alloys were investigated, and the yield strength and ultimate strength of the 10Ni alloy were highest, at 219 MPa and 240 MPa. After compression at 1000°C, the dislocations cannot effectively shear the γ ′ phase in the 0Ni and 10Ni alloys, resulting in a relatively high compressive strength of the 0Ni and 10Ni alloys. However, the γ ′ phase of the 5Ni alloy is no longer visible, and its strength is the lowest.

Effects of Al substitution by Si in Ti3AlC2 nanolaminate

Recently, a series of high-purity Ti3(Al1−xSix)C2 solid solutions with new compositions (x = 0.0, 0.2, 0.4, 0.6, 0.8 and 1.0) have been reported with interesting mechanical properties. Here, we have employed density functional theory for Ti3(Al1−xSix)C2 solid solutions to calculate a wider range of physical properties including structural, electronic, mechanical, thermal and optical. With the increase of x, a decrease of cell parameters is observed. All elastic constants and moduli increase with x. The Fermi level gradually increases, moving towards and past the upper bound of the pseudogap, when the value of x goes from zero to unity, indicating that the structural stability reduces gradually when the amount of Si increases within the Ti3(Al1−xSix)C2 system. In view of Cauchy pressure, Pugh’s ratio and Poisson’s ratio all compositions of Ti3(Al1−xSix)C2 are brittle in nature. Comparatively, low Debye temperature, lattice thermal conductivity and minimum thermal conductivity of Ti3AlC2 favor it to be a thermal barrier coating material. High melting temperatures implies that the solid solutions Ti3(Al1−xSix)C2 may have potential applications in harsh environments. In the visible region (1.8–3.1 eV), the minimum reflectivity of all compositions for both polarizations is above 45%, which makes them potential coating materials for solar heating reduction.

The Behavior of NH3+ Torsional Vibration in Amino Acids: A Raman Spectroscopic Study

In this work we present the continuation of studies carried out on the changes of geometric parameters of the hydrogen bonds in amino acid crystals subjected to temperature or pressure variations. Changes in geometric parameters of the hydrogen bonds are correlated with the temperature behavior of the Raman wavenumber of NH3+ torsional band. Now four monocrystals, L-valine, L-isoleucine, taurine, and L-arginine hydrochloride monohydrate, are studied. Temperature evolution of the Raman wavenumber of NH3+ torsional band, with positive slope (dν/dT = 0.023 cm−1/K) of L-isoleucine, can be related to the stability of the crystal structure and the hydrogen bonds strengths on heating due to different temperature lattice parameters variation.

First principles investigation of structural, vibrational and thermal properties of black and blue phosphorene

In this investigation, structural, dynamical and thermal properties of black and blue phosphorene (P) are presented through the first principles calculations based on the density functional theory (DFT). These DFT calculations depict that due to the approximately same values of ground state energy at zero Kelvin and Helmholtz free energy at room-temperature, it is expected that both structures can coexist at transition temperature. Lattice dynamics of both phases were investigated by using the finite displacement supercell approach. It is noticed on the basis of harmonic approximation thermodynamic calculations that the blue phase is thermodynamically more stable than the black phase above 155 K.