Recommended values of the thermophysical properties of eight alloys, their major constituents and oxides

Reference work provides in tabular and graphical form the thermophysical properties of basic alloys, their constituents and oxides. This is useful for personnel who deal with extreme temperature environments

Recommended Values of the Thermophysical Properties of Eight Alloys, Major Constituents and Their Oxides, February 1, 1965 - January 31, 1966

Thermophysical properties of aluminum, beryllium, Inconel, stainless steel, and titanium alloys and primary oxide

How Stress Can Reduce Dissipation in Glasses

We propose that stress can decrease the internal friction of amorphous solids, either by increasing the potential barriers of defects, thus reducing their tunneling and thermal activation that produce loss, or by decreasing the coupling between defects and phonons. This stress can be from impurities, atomic bonding constraints, or externally applied stress. Externally applied stress also reduces mechanical loss through dissipation dilution. Our results are consistent with the experiments, and predict that stress could substantially reduce dielectric loss and increase the thermal conductivity.Comment: 9 pages, 7 figure

Assessing the Performance of Recent Density Functionals for Bulk Solids

We assess the performance of recent density functionals for the exchange-correlation energy of a nonmolecular solid, by applying accurate calculations with the GAUSSIAN, BAND, and VASP codes to a test set of 24 solid metals and non-metals. The functionals tested are the modified Perdew-Burke-Ernzerhof generalized gradient approximation (PBEsol GGA), the second-order GGA (SOGGA), and the Armiento-Mattsson 2005 (AM05) GGA. For completeness, we also test more-standard functionals: the local density approximation, the original PBE GGA, and the Tao-Perdew-Staroverov-Scuseria (TPSS) meta-GGA. We find that the recent density functionals for solids reach a high accuracy for bulk properties (lattice constant and bulk modulus). For the cohesive energy, PBE is better than PBEsol overall, as expected, but PBEsol is actually better for the alkali metals and alkali halides. For fair comparison of calculated and experimental results, we consider the zero-point phonon and finite-temperature effects ignored by many workers. We show how Gaussian basis sets and inaccurate experimental reference data may affect the rating of the quality of the functionals. The results show that PBEsol and AM05 perform somewhat differently from each other for alkali metal, alkaline earth metal and alkali halide crystals (where the maximum value of the reduced density gradient is about 2), but perform very similarly for most of the other solids (where it is often about 1). Our explanation for this is consistent with the importance of exchange-correlation nonlocality in regions of core-valence overlap.Comment: 32 pages, single pdf fil

Coil optimization for electromagnetic levitation using a genetic like algorithm

he technique of electromagnetic levitation (EML) provides a means for thermally processing an electrically conductive specimen in a containerless manner. For the investigation of metallicliquids and related melting or freezing transformations, the elimination of substrate-induced nucleation affords access to much higher undercooling than otherwise attainable. With heating and levitation both arising from the currents induced by the coil, the performance of any EML system depends on controlling the balance between lifting forces and heating effects, as influenced by the levitation coil geometry. In this work, a genetic algorithm is developed and utilized to optimize the design of electromagnetic levitation coils. The optimization is targeted specifically to reduce the steady-state temperature of the stably levitated metallic specimen. Reductions in temperature of nominally 70 K relative to that obtained with the initial design are achieved through coil optimization, and the results are compared with experiments foraluminum. Additionally, the optimization method is shown to be robust, generating a small range of converged results from a variety of initial starting conditions. While our optimizationcriterion was set to achieve the lowest possible sample temperature, the method is general and can be used to optimize for other criteria as well

Thermoelastic dissipation in inhomogeneous media: loss measurements and displacement noise in coated test masses for interferometric gravitational wave detectors

The displacement noise in the test mass mirrors of interferometric gravitational wave detectors is proportional to their elastic dissipation at the observation frequencies. In this paper, we analyze one fundamental source of dissipation in thin coatings, thermoelastic damping associated with the dissimilar thermal and elastic properties of the film and the substrate. We obtain expressions for the thermoelastic dissipation factor necessary to interpret resonant loss measurements, and for the spectral density of displacement noise imposed on a Gaussian beam reflected from the face of a coated mass. The predicted size of these effects is large enough to affect the interpretation of loss measurements, and to influence design choices in advanced gravitational wave detectors.Comment: 42 pages, 7 figures, uses REVTeX

Thermodynamic properties and structural stability of thorium dioxide

Using density functional theory (DFT) calculations, we have systematically investigated the thermodynamic properties and structural stabilities of thorium dioxide (ThO$_2$). Based on the calculated phonon dispersion curves, we calculate the thermal expansion coefficient, bulk modulus, and heat capacities at different temperatures for ThO$_2$ under the quasi-harmonic approximation. All the results are in good agreement with corresponding experiments proving the validity of our methods. Our theoretical studies can help people more clearly understand the thermodynamic behaviors of ThO$_2$ at different temperatures. In addition, we have also studied possible defect formations and diffusion behaviors of helium in ThO$_2$, to discuss its structural stability. It is found that in intrinsic ThO$_2$ without any Fermi energy shifts, the interstitial Th$_i^{4+}$ defect other than oxygen or thorium vacancies, interstitial oxygen, and any kinds of Frenkel pairs, is most probable to form with an energy release of 1.74 eV. However, after upshifting the Fermi energy, the formation of the other defects also becomes possible. For helium diffusion, we find that only through the thorium vacancy can it happen with the small energy barrier of 0.52 eV. Otherwise, helium atoms can hardly incorporate or diffuse in ThO$_2$. Our results indicate that people should prevent upshifts of the Fermi energy of ThO$_2$ to avoid the formation of thorium vacancies and so as to prevent helium caused damages.Comment: 11 pages, 11 figure

Force-matched embedded-atom method potential for niobium

Large-scale simulations of plastic deformation and phase transformations in alloys require reliable classical interatomic potentials. We construct an embedded-atom method potential for niobium as the first step in alloy potential development. Optimization of the potential parameters to a well-converged set of density-functional theory (DFT) forces, energies, and stresses produces a reliable and transferable potential for molecular dynamics simulations. The potential accurately describes properties related to the fitting data, and also produces excellent results for quantities outside the fitting range. Structural and elastic properties, defect energetics, and thermal behavior compare well with DFT results and experimental data, e.g., DFT surface energies are reproduced with less than 4% error, generalized stacking-fault energies differ from DFT values by less than 15%, and the melting temperature is within 2% of the experimental value.Comment: 17 pages, 13 figures, 7 table

Reduction of thermal fluctuations in a cryogenic laser interferometric gravitational wave detector

The thermal fluctuation of mirror surfaces is the fundamental limitation for interferometric gravitational wave (GW) detectors. Here, we experimentally demonstrate for the first time a reduction in a mirror's thermal fluctuation in a GW detector with sapphire mirrors from the Cryogenic Laser Interferometer Observatory at 17\,K and 18\,K. The detector sensitivity, which was limited by the mirror's thermal fluctuation at room temperature, was improved in the frequency range of 90\,Hz to 240\,Hz by cooling the mirrors. The improved sensitivity reached a maximum of $2.2 \times 10^{-19}\,\textrm{m}/\sqrt{\textrm{Hz}}$ at 165\,Hz.Comment: Accepted for publication in Physical Review Letters, 5 pages, 2 figure