Effect of Previous Milling of Precursors on Magnetoelectric Effect in Multiferroic {\mathrm{Bi}_{5}\mathrm{Ti}_{3}\mathrm{FeO}_{15}} Ceramic

$\mathrm{Bi}_{5}\mathrm{Ti}_{3}\mathrm{FeO}_{15}$ Bi 5 Ti 3 FeO 15 magnetoelectric (ME) ceramics have been synthesized and investigated. The ME effect can be described as an induced electric polarization under an external magnetic field or an induced magnetization under an external electric field. The materials in the ME effect are called ME materials, and they are considered to be a kind of new promising materials for sensors, processors, actuators, and memory systems. Multiferroics, the materials in which both ferromagnetism and ferroelectricity can coexist, are the prospective candidates which can potentially host the gigantic ME effect. $\mathrm{Bi}_{5}\mathrm{Ti}_{3}\mathrm{FeO}_{15}$ Bi 5 Ti 3 FeO 15 , an Aurivillius compound, was synthesized by sintering a mixture of $\mathrm{Bi}_{2}\mathrm{O}_{3}, \mathrm{Fe}_{2}\mathrm{O}_{3}$ Bi 2 O 3 , Fe 2 O 3 , and $\mathrm{TiO}_{2}$ TiO 2 oxides. The precursor materials were prepared in a high-energy attritorial mill for (1, 5, and 10) h. The orthorhombic $\mathrm{Bi}_{5}\mathrm{Ti}_{3}\mathrm{FeO}_{15}$ Bi 5 Ti 3 FeO 15 ceramics were obtained by a solid-state reaction process at 1313 K. The ME voltage coefficient ( $\alpha _\mathrm{ME}$ α ME ) was measured using the dynamic lock-in method. The highest ME voltage coefficient ( $\alpha _\mathrm{ME} = 8.28\,\text{ mV }{\cdot }\text{ cm }^{-1}{\cdot }\text{ Oe }^{-1})$ α ME = 8.28 mV · cm ? 1 · Oe ? 1 ) is obtained for the sample milled for 1 h at $H_\mathrm{DC }= 4$ H DC = 4  Oe (1 Oe = 79.58  $\text{ A }{\cdot }\text{ m }^{-1})$ A · m ? 1 ) .     

Transfer Partial Molar Isentropic Compressibilities of (l-Alanine/l-Glutamine/Glycylglycine) from Water to 0.512 {\mathrm{mol}}\!\cdot \!{\mathrm{kg}}^{-1} Aqueous {\mathrm{KNO}}_{3}/0.512\, {\mathrm{mol}}\!\cdot \! {\mathrm{kg}}^{-1} Aqueous {\mathrm{K}}_{2}{\mathrm{SO}}_{4} Solutions Between 298.15 K and 323.15 K

Speeds of sound of (l-alanine/l-glutamine/glycylglycine $\,+\, 0.512\, {\mathrm{mol}}\cdot {\mathrm{kg}}^{-1}$ + 0.512 mol · kg ? 1 aqueous ${\mathrm{KNO}}_{3}/0.512\, {\mathrm{mol}}\cdot {\mathrm{kg}}^{-1}$ KNO 3 / 0.512 mol · kg ? 1 aqueous ${\mathrm{K}}_{2}{\mathrm{SO}}_{4}$ K 2 SO 4 ) systems have been measured for several molal concentrations of amino acid/peptide at different temperatures: $T$ T = (298.15 to 323.15) K. Using the speed-of-sound and density data, the parameters, partial molar isentropic compressibilities $\phi _{\kappa }^{0}$ ? κ 0 and transfer partial molar isentropic compressibilities $\Delta _{\mathrm{tr}} \phi _{\kappa }^{0}$ Δ tr ? κ 0 , have been computed. The trends of variation of $\phi _{\kappa }^{0}$ ? κ 0 and $\Delta _{\mathrm{tr}} \phi _{\kappa }^{0}$ Δ tr ? κ 0 with changes in molal concentration of the solute and temperature have been discussed in terms of zwitterion–ion, zwitterion–water dipole, ion–water dipole, and ion–ion interactions operative in the systems.     

Thermal Conductivity of Standard Sands. Part III. Full Range of Saturation

The thermal conductivity $(\lambda )$ ( λ ) of three unsaturated standard quartz sands (Ottawa C-109 and C-190, and Toyoura) was measured by a transient thermal-conductivity probe, at room temperature of approximately $25\,^{\circ }\text{ C }$ 25 ° C and at loose and tight compactions. The measurements were carried out at different degrees of saturation $(S_\mathrm{r})$ ( S r ) from dryness to full saturation. In general, a sharp $\lambda $ λ increase was observed at low $S_\mathrm{r}$ S r , followed by a moderate rise until full saturation. However, experiments on loosely compacted C-190 samples revealed $\lambda $ λ deviation from a general trend ( $\lambda $ λ vs $S_\mathrm{r})$ S r ) caused by water percolation. Alternatively, successful experiments were carried out on loosely packed unsaturated C-190 samples using 1 % agar gel. For loosely compacted C-109 and Toyoura, $\lambda $ λ data obtained from 1 % agar gel closely agreed with $\lambda $ λ data for water as a saturation medium. The measured data were used to verify a model by de Vries for unsaturated soils. The model largely underestimates experimental data at $S_\mathrm{r}<0.5$ S r < 0.5 and produces an overall root-mean-square error of about $0.2\, \text{ W }~{\cdot }~\text{ m }^{-1}~{\cdot }~\text{ K }^{-1}$ 0.2 W · m ? 1 · K ? 1 . Measured $\lambda $ λ data agreed with data by a steady-state technique (a guarded hot-plate apparatus) at dryness and full saturation and exceeded the steady-state data in the unsaturated region. However, TCP data can be considered more reliable due to a lower temperature increase during $\lambda $ λ measurements and a shorter testing time. Consequently, in the case of unsaturated soils, evaporation and migration of water and steam can be avoided.     

Experimental Measurements of Thermophysical Properties of \mathrm{Al}_{2}\mathrm{O}_{3}– and \mathrm{TiO}_{2}–Ethylene Glycol Nanofluids

This paper presents measurements of the thermal conductivity and the dynamic viscosity of $\mathrm{Al}_{2}\mathrm{O}_{3}$ Al 2 O 3 –ethylene glycol and $\mathrm{TiO}_{2}$ TiO 2 –ethylene glycol (1 % to 3 % particle volume fraction) nanofluids carried out in the temperature range from $0\,^{\circ }$ 0 ° C to $50\,^{\circ }$ 50 ° C. The thermal-conductivity measurements were performed by using a transient hot-disk TPS 2500S apparatus instrumented with a 7577 probe (2.001 mm in radius) having a maximum uncertainty $(k=2)$ ( k = 2 ) lower than 5.0 % of the reading. The dynamic-viscosity measurements and the rheological analysis were carried out by a rotating disk type rheometer Haake Mars II instrumented with a single-cone probe (60 mm in diameter and $1^{\circ }$ 1 ° ) having a maximum uncertainty $(k=2)$ ( k = 2 ) lower than 5.0 % of the reading. The thermal-conductivity measurements of the tested nanofluids show a great sensitivity to particle volume fraction and a lower sensitivity to temperature: $\mathrm{TiO}_{2}$ TiO 2 –ethylene glycol and $\mathrm{Al}_{2}\mathrm{O}_{3}$ Al 2 O 3 –ethylene glycol nanofluids show a thermal-conductivity enhancement (with respect to pure ethylene glycol) from 1 % to 19.5 % and from 9 % to 29 %, respectively. $\mathrm{TiO}_{2}$ TiO 2 –ethylene glycol and $\mathrm{Al}_{2}\mathrm{O}_{3}$ Al 2 O 3 –ethylene glycol nanofluids exhibit Newtonian behavior in all the investigated temperature and particle volume fraction ranges. The relative viscosity shows a great sensitivity to the particle volume fraction and weak or no sensitivity to temperature: $\mathrm{TiO}_{2}$ TiO 2 –ethylene glycol and $\mathrm{Al}_{2}\mathrm{O}_{3}$ Al 2 O 3 –ethylene glycol nanofluids show a dynamic viscosity increase with respect to ethylene glycol from (4 to 5) % to 30 % and from 14 % to 50 %, respectively. Present experimental measurements were compared both with available measurements carried out by different researchers and computational models for thermophysical properties of nanofluids.     

Measurement and Modeling of Water-Vapor Diffusion in Elastomers with Impact in Humidity and Vacuum Measurements

The dynamics of water-vapor dissolution in Viton O-rings is measured with a gravimetric method using a precise mass comparator. A sample gasket was degassed in high vacuum for a sufficiently long period to remove more than 99 % of the dissolved water vapor. After that, it was exposed to the ambient atmosphere with a controlled temperature, and relative humidity and water-vapor uptake curves were measured gravimetrically with a precise balance. The dynamics of a water-vapor release into vacuum from another sample that was previously saturated with water vapor at room temperature was determined. The sample was placed in a vacuum outgassing rate measurement apparatus. The time dependence of the evolved water vapor was calculated by integrating the measured outgassing rate. The physical process of water absorption can be described by the diffusion equation. The geometry of the samples required solving the diffusion equation in cylindrical coordinates. This was done numerically using a finite-difference method. As a result of the modeling, room temperature values of the diffusion constant $D$ D , the solubility $s$ s , and the permeability $K = D\times s$ K = D × s of water vapor in the sample material (Viton A-401C) were obtained. For sample 1, we obtained $D = 8.0 \times 10 ^{-8}$ D = 8.0 × 10 ? 8  cm $^{2}\,\,{\cdot }\,\,$ 2 · s $^{-1}$ ? 1 and $s = 6.5 \times 10^{-7}$ s = 6.5 × 10 ? 7  g $\,{\cdot }\,$ · cm $^{-3}\,{\cdot }\,$ ? 3 · Pa $^{-1}$ ? 1 , while for sample 2, $D = 3.0 \times 10^{-7}$ D = 3.0 × 10 ? 7  cm $^{2}\,{\cdot }\,$ 2 · s $^{-1}$ ? 1 and $s = 3.5 \times 10^{-7}$ s = 3.5 × 10 ? 7  g $\,{\cdot }\,$ · cm $^{-3}\,{\cdot }\,$ ? 3 · Pa $^{-1}$ ? 1 .     

Theoretical Investigations on Electrocaloric Properties of \mathrm{PbZr}_{0.95}\mathrm{Ti}_{0.05}\mathrm{O}_{3} Thin Film

Based on a phenomenological model, the electrocaloric effect (ECE) accompanied with the ferroelectric-to-paraelectric phase transition in a PbZr $_{0.95}$ 0.95 Ti $_{0.05}$ 0.05 O $_{3}$ 3 thin film was investigated. The extracted data reveal many features of the ECE such as electrocaloric entropy changes, heat capacity changes, and temperature changes as functions of temperature due to different electric fields shifts. From the behavior of the PbZr $_{0.95}$ 0.95 Ti $_{0.05}$ 0.05 O $_{3}$ 3 thin film in phase transitions, it leads to a large change of heat capacity of 105.94 J  ${\cdot }\,$ · kg ${^{-1}}\,{\cdot }\,{^{\circ }}$ ? 1 · ° C, a temperature change of 22.44 K, and a relative cooling power of 1469 J  ${\cdot }$ ·  kg $^{-1}$ ? 1 .     

Influence of pH and bath composition on properties of Ni–Fe alloy films synthesized by electrodeposition

Fe?CNi films were electrodeposited on ITO glass substrates from the electrolytes with different molar ratio of Ni $^{\boldsymbol{2+}}$ /Fe $^{\boldsymbol{2+}}$ and different pH values (2 $\boldsymbol{\cdot}$ 1, 2 $\boldsymbol{\cdot}$ 9, 3 $\boldsymbol{\cdot}$ 7 and 4 $\boldsymbol{\cdot}$ 3) at 25 $\boldsymbol{^\circ}$ C. The properties of Fe?CNi alloy films depend on both Ni $^{\boldsymbol{2+}}$ and Fe $^{\boldsymbol{2+}}$ concentrations in electrolyte and pH values. The content of Ni increases from 38% to 84% as the mole ratio of NiSO $_{\boldsymbol{4}}$ /FeSO $_{\boldsymbol{4}}$ increasing from 0 $\boldsymbol{\cdot}$ 50/0 $\boldsymbol{\cdot}$ 50 to 0 $\boldsymbol{\cdot}$ 90/0 $\boldsymbol{\cdot}$ 10 in electrolyte and slightly decreases from 65% to 42% as the pH values increase from 2 $\boldsymbol{\cdot}$ 1 to 4 $\boldsymbol{\cdot}$ 3. The X-ray diffraction analysis reveals that the structures of the films strongly depend on the Ni content in the binary films. The magnetic performance of the films shows that the saturation magnetization ( $\boldsymbol{M}_{\boldsymbol{\rm s}})$ decreases from 1775 $\boldsymbol{\cdot}$ 01 emu/cm $^{\boldsymbol{3}}$ to 1501 $\boldsymbol{\cdot}$ 46 emu/cm $^{\boldsymbol{3}}$ with the pH value increasing from 2 $\boldsymbol{\cdot}$ 1 to 4 $\boldsymbol{\cdot}$ 3 and the saturation magnetization ( $\boldsymbol{M}_{\boldsymbol{\rm s}})$ and coercivity ( $\boldsymbol{H}_{\boldsymbol{\rm c}})$ move up from 1150 $\boldsymbol{\cdot}$ 44 emu/cm $^{\boldsymbol{3}}$ and 58 $\boldsymbol{\cdot}$ 86 Oe to 2498 $\boldsymbol{\cdot}$ 88 emu/cm $^{\boldsymbol{3}}$ and 93 $\boldsymbol{\cdot}$ 12 Oe with the increase of Ni $^{\boldsymbol{2+}}$ concentration in the electrolyte, respectively.     

Evaluation of Power Heat Losses in Multidomain Iron Particles Under the Influence of AC Magnetic Field in RF Range

The magnetic properties and hyperthermia effect were studied in a magnetorheological fluid (MRF) containing iron particles of $1 \upmu \mathrm{m}\, \text{ to}\, 5 \,\upmu \mathrm{m}$ in diameter. The measurements showed that the magnetization in the saturation state reaches a value of 171 $\text{ A}\cdot \text{ m}^{2}\cdot \mathrm{kg}^{-1}$ with very small values of coercivity and remanence. They also showed the ferromagnetic behavior in the system together with a value of the magnetic susceptibility of 1.7. Theoretical and experimental results of the calorimetric effect investigation under a changeable magnetic field of high frequency ( $f = 504$ kHz) in an MRF will be presented in the article. The sample was subjected to an alternating magnetic field of different strengths ( $H = 0$ to 4 $\text{ kA}\cdot \text{ m}^{-1})$ . It results from a theoretical analysis that the heat power density (released in the MRF sample) referenced to the eddy current is proportional to the square of frequency, the magnetic field amplitude, and the iron grain diameter. Experimental results indicate that there are some reasons for the released heat energy such as: energy losses from magnetic hysteresis and eddy currents induced in the iron grains. If the magnetic field intensity amplitude grows, the participation of losses connected with magnetic hysteresis is increased. From the calorimetric measurements, the conclusion is as follows: for a magnetic field $H<1946\,\text{ A}\cdot \mathrm{m}^{-1}$ , the eddy current processes dominate in the heat generation mechanism, whereas hysteresis processes for the total release of thermal energy dominate for higher magnetic fields. Both mechanisms take equal parts in heating the tested sample at a magnetic field intensity amplitude $H= 1946\,\text{ A}\cdot \mathrm{m}^{-1}$ . The specific absorption rate referenced to the mass unit of the MRF sample at the amplitude of the magnetic field strength 4 $\text{ kA}\cdot \mathrm{m}^{-1}$ equals 24.94 $\text{ W} \cdot \mathrm{kg}^{-1}$ at a frequency $f$ = 504 kHz.     

Liquidus Temperatures and Thermodynamic Properties of the KCl–\mathrm{{KNO}}_{2}, NaCl–\mathrm{{NaNO}}_{2}, and \mathrm{{KNO}}_{2}–\mathrm {NaNO}_{2} Systems

Potassium nitrite is very sensitive to temperature, humidity, and the atmosphere, so few studies have been made in this field for the thermodynamic properties of molten salt with nitrite salt. In this article, the liquidus curves of NaCl– $\mathrm{{NaNO}}_{2}$ NaNO 2 , KCl– $\mathrm{{KNO}}_{2}$ KNO 2 , and $\mathrm {NaNO}_{2}$ NaNO 2 – $\mathrm{{KNO}}_{2}$ KNO 2 are calculated by a simple “hard-sphere” ionic interaction model. The calculated liquidus temperatures show good agreement with experimental values, which implies an ideal mixing enthalpy and entropy for the liquid binary systems. In addition to the phase equilibrium data and experimental thermochemical properties of molten salt systems, the activities of these binary systems are determined by the phase diagrams and the analytical integration of the classical Gibbs–Duhem equation.     

A Study of Some Thermophysical Parameters in Glassy \mathrm{{Se}}_{80}\mathrm{{Te}}_{20} and \mathrm{{Se}}_{80}\mathrm{{Te}}_{10}\mathrm{{M}}_{10} (Cd, In, and Sb) Alloys

The present paper reports a comparative study of some thermophysical properties (thermal conductivity, thermal diffusivity, thermal effusivity, and specific heat per unit volume) for $\mathrm{{Se}}_{80}\mathrm{{Te}}_{20}$ Se 80 Te 20 and $\mathrm{{Se}}_{80}\mathrm{{Te}}_{10}\mathrm{{M}}_{10}$ Se 80 Te 10 M 10 (Cd, In, and Sb) alloys. The transient plane source technique is used for this purpose. The thermal conductivity is highest for $\mathrm{{Se}}_{80}\mathrm{{Te}}_{10}\mathrm{{In}}_{10}$ Se 80 Te 10 In 10 as compared to the other ternary alloys. This is explained in terms of the thermal conductivity of additive elements Cd, In, and Sb. The composition dependence of the thermal diffusivity and specific heat per unit volume is also discussed.     

Phase relation of LaFe 11·6 Si 1·4 compounds annealed at different high-temperature and the magnetic property of LaFe 11·6– x Co x Si 1·4 compounds

LaFe _11·6 Si _1·4 compounds are annealed at different high temperatures from 1323 to 1623?K. The powder X-ray diffraction patterns show that large amount of NaZn₁₃-type phase begins to be observed in LaFe _11·6 Si _1·4 compound after being annealed at 1423?K for 5?h. In the temperature range from 1423 to 1523?K, the $\boldsymbol{\alpha} $ -Fe and LaFeSi phases rapidly decrease to form 1:13 phase. LaFeSi phase is rarely observed in the XRD pattern in the LaFe _11·6 Si _1·4 compound annealed at 1523?K (5?h). With annealing temperature increasing to 1573?K and 1673?K, La ₅ Si ₃ phase is detected, and there is a certain amount of LaFeSi phase when the annealing temperature is 1673?K. The amount of impurity phases in the LaFe _11·6 Si _1·4 compound annealed by the two-stage annealing consisting of high temperature ( $\boldsymbol{>}$ 1523?K) and 1523?K is larger than that of the single stage annealing at 1523?K under the same time. According to the results of different high-temperature annealing, LaFe $_{{\bf 11{\cdot}6}-\boldsymbol{x}}$ Co $_{\boldsymbol{x}}$ Si _1·4 ( $\boldsymbol{0{\cdot}1} \boldsymbol{\le} \boldsymbol{x} \boldsymbol{\le} \boldsymbol{0{\cdot}8}$ ) compounds are annealed at 1523?K (5?h). The main phase is NaZn13-type phase, and the impurity phase is a small amount of $\boldsymbol{\alpha} $ -Fe in LaFe $_{{\bf 11{\cdot}6}-\boldsymbol{x}}$ Co $_{\boldsymbol{x}}$ Si _1·4 compounds. With increase in Co content from $\boldsymbol{x} \boldsymbol{=} \boldsymbol{0{\cdot}1}$ to $\boldsymbol{0{\cdot}8}$ , the Curie temperature $\boldsymbol{T}_{\!\boldsymbol{\rm C}}$ , goes up from 207 to 285?K. The introduction of Co element weakens the itinerant electron metamagnetic transition, and also results in the change of magnetic transition type from first to second order at about $\boldsymbol{x = 0{\cdot}5}$ . The magnetic entropy change decreases from 19·94 to 4·57?J /kg K with increasing Co concentration at a low magnetic field of 0?C2?T. But the magnetic hysteresis loss around $\boldsymbol{T}_{\!\boldsymbol{\rm C}}$ reduces remarkably from 26·2?J /kg for $\boldsymbol{x = 0{\cdot}1}$ to 0?J /kg for $\boldsymbol{x} \boldsymbol{=} \bf 0{\cdot}8$ .     

Spin-Polarized Calculations of Magnetic and Thermodynamic Properties of the Full-Heusler \mathrm{{Co}}_{2}MnZ (Z = Al, Ga)

The purpose of this study is to further understanding of the structural, electronic, magnetic, and thermal properties of the full-Heusler compounds, ${\mathrm{{Co}}}_{2}$ Co 2 MnAl and ${\mathrm{{Co}}}_{2}$ Co 2 MnGa, using density functional theory. Electronic structure calculations will be performed using the full potential linear augmented plane wave. The electronic structures and magnetic properties of ${\mathrm{{Co}}}_{2}$ Co 2 MnZ (Z = Al, Ga) compounds with ${\mathrm{L}}2_{1 }$ L 2 1 structure are studied. It is shown that the calculated lattice constants and spin magnetic moments are in good agreement with experimental values using the general gradient approximation method. Thermal effects on some macroscopic properties of ${\mathrm{{Co}}}_{2}$ Co 2 MnZ (Z = Al, Ga) compounds are predicted using the quasi-harmonic Debye model, in which the lattice vibrations are taken into account. The variations of the lattice constant, volume expansion coefficient, heat capacities, and Debye temperature with pressure and temperature in the ranges of 0 GPa to 18 GPa and 0 K to700 K have been obtained.     

Magnetic Properties of Nanocrystalline Nickel–Cobalt Ferrites (\mathrm{Ni}_{1/2}{\mathrm{{Co}}}_{1/2}{\mathrm{{Fe}}}_{2}{\mathrm{O}}_{4})

In this study, the nanocrystalline nickel–cobalt ferrites $(\mathrm{Ni}_{1/2}\mathrm{Co}_{1/2}\mathrm{Fe}_{2}\mathrm{O}_{4})$ were prepared via the citrate route method at $27\,^{\circ }\mathrm{C}$ . The samples were calcined at $300\,^{\circ }\mathrm{C}$ for 3 h. The crystalline structure and the single-phase formations were confirmed by X-ray diffraction (XRD) measurements. Prepared materials showed the cubic spinel structure with m3m symmetry and Fd3m space group. The analyses of XRD patterns were carried out using POWD software. It gave an estimation of lattice constant “ $a$ ” of 8.3584 Å, which was in good agreement with the results reported in JCPDS file no. 742081. The crystal size of the prepared materials calculated by Scherer’s formula was 27.6 nm and the electrical conductivity was around $10^{-5}~\mathrm{S}\,\cdot \, \mathrm{m}^{-1}$ . The permeability component variations with frequency were realized. The magnetic properties of the prepared materials were analyzed by a vibrating sample magnetometer (VSM). It showed a saturation magnetization of $27.26\,\mathrm{emu} \cdot \mathrm{m}^{-1}$ and the behavior of a hard magnet.     

Photoacoustic Measurement of Thermal Properties of Co–Ni–Li Ferrite Nanoparticles

A simple home-made open photoacoustic cell is used for measuring some of the thermal properties of nanoparticles of $\mathrm{{Co}}_{0.5}\mathrm{{Ni}}_{0.5\text{-- }2{x}}\mathrm{{Li}}_x\text{ Fe }_{2+{x}}\mathrm{{O}}_{4}$ Co 0.5 Ni 0.5 -- 2 x Li x Fe 2 + x O 4 (with $x$ x ranging from 0.00 to 0.25 in steps of 0.05) prepared by the citrate precursor method. The influence of sintering temperatures on the thermal properties of a selected sample for $x=0.25$ x = 0.25 was also investigated. The thermal-diffusivity and thermal-effusivity measurements of the investigated samples are obtained by measuring the photoacoustic signal as a function of the modulated frequency depending on the existence of a reference sample. The thermal diffusivity of the as-prepared samples decreases as the $\mathrm{{Li}}^{1+}$ Li 1 + content increases except for the samples for $x=0.15$ x = 0.15 and $x=0.20$ x = 0.20 . These exceptions may be due to a better magnetic ordering in these samples leading to reduced phonon scattering and a higher thermal diffusivity. Finally, the thermal diffusivity of the sintered samples increases as the sintering temperature increases due to the increase in grain size.     

Study of Glass-Transition Kinetics of Pb-Modified Se_{80}In_{20} System by Using Non-isothermal Differential Scanning Calorimetry

Glass-transition kinetics of $\mathrm{Se}_{80}\mathrm{In}_{20-\mathrm{x}}\mathrm{Pb}_{\mathrm{x}}$ ( $x =$ 0, 5, 10, and 15) chalcogenide glasses have been carried out at different heating rates by using differential scanning calorimeter (DSC) under the non-isothermal condition. The glass-transition temperature $T_{\mathrm{g}}$ and peak glass-transition temperature $T_{\mathrm{pg}}$ have been determined from DSC thermograms. The reduced glass temperature $T_{\mathrm{rg}}$ , total relaxation time $\tau _{T_{g}}$ thermal-stability parameters $K^{l}$ and $S$ , the activation energy of glass transition $E_{\mathrm{g}}$ , the fragility index $F_{\mathrm{i}}$ , and the average coordination number $\langle Z\rangle $ have been calculated on the basis of the experimental results. The temperature differences $(T_{\mathrm{c}}-T_{\mathrm{g}}), K_{\mathrm{gl}}, K^{l}, S$ , and $E_{\mathrm{g}}$ are found to be maxima for $\mathrm{Se}_{80}\mathrm{In}_{10}\mathrm{Pb}_{10}$ glass. This indicates that $\mathrm{Se}_{80}\mathrm{In}_{10}\mathrm{Pb}_{10}$ glass has the highest thermal stability and glass-forming ability in the investigated compositional range. These results could be explained on the basis of modification of the chemical bond formation due to incorporation of Pb in the Se–In glassy matrix.     

Optimal (v,5,2,1) optical orthogonal codes of small v

We classify up to multiplier equivalence optimal $(v, 5, 2, 1)$ ( v , 5 , 2 , 1 ) optical orthogonal codes (OOC) with $v\le 114$ v ≤ 114 . Examples of optimal $(v, 5, 2, 1)$ ( v , 5 , 2 , 1 ) OOCs are presented for all $v\le 155$ v ≤ 155 , for which an optimal OOC exists.     

The theoretical calculation of the flow rate of granular matter from an inclined orifice

A theoretical calculation method for the flow rate of granular matter from an inclined orifice is discussed in this article and for the inclination angles at $\theta \le 90^{\circ }$ , a theoretical relation between the flow rate $Q$ and inclination angle $\theta $ is derived; and for the inclination angles at $\theta >90^{\circ }$ , a semi-theoretical relation is established. From the relations, we found that the ratio of the flow rate from a vertical orifice, $Q_{90}$ , to that from a horizontal orifice, $Q_{0}$ , is equal to the sine of the angle of repose $\theta _{\mathrm{r}}$ , i.e., $Q_{90} /Q_0 =\sin \theta _{\mathrm{r}} $ . The theoretical relations are tested by means of the experimental data and the results indicate that the theoretical calculating values are in good agreement with the experimental data over a wide range of the inclination angles. Therefore, the formula proposed in this article can be used for the theoretical calculation of the flow rate of granular matter from an inclined orifice. The relation $Q_{90} /Q_0 =\sin \theta _{\mathrm{r}}$ may be used as an alternative approach to obtaining $\theta _{\mathrm{r}}$ : measuring $Q_{90}$ and $Q_{0}$ , and then calculating $\theta _{\mathrm{r}} $ by using formula $\theta _{\mathrm{r}} =\arcsin (Q_{90} /Q_0 )$ .     

Thermal Conductivity in Zeolites Studied by Non-equilibrium Molecular Dynamics Simulations

The thermal conductivity of zeolites is an important material property. For example, this is the case for catalysis, where chemical reactions release heat either inside zeolites or at zeolite surfaces. At zeolite surfaces, heat is released during the adsorption of guest molecules. Unfortunately, it can be difficult to determine the thermal conductivity of zeolites from experiments or from equilibrium molecular dynamics simulations. Non-equilibrium molecular dynamics (NEMD) simulation is an interesting approach to determine thermal conductivities. Inducing a thermal gradient by moving kinetic energy between different parts of the simulation box, and then studying the resulting thermal gradient, will lead to direct access to the thermal conductivity of the zeolite. In this work, we have used NEMD simulations to determine the thermal conductivity of several pure silica zeolites. The zeolites are modeled using the Demontis force field, making it possible to screen many zeolite frameworks, and study finite-size effects. In addition, we have studied the influence of adsorbed guest molecules on the thermal conductivity. The thermal conductivity of zeolites is usually in order of 0.6  $\mathrm{W}\cdot \mathrm{m}^{-1}\cdot \mathrm{K}^{-1}$ W · m ? 1 · K ? 1 to almost 4  $\mathrm{W}\cdot \mathrm{m}^{-1}\cdot \mathrm{K}^{-1}$ W · m ? 1 · K ? 1 , with large differences between different crystallographic directions. We find that the loading of guest molecules adsorbed inside the zeolite has a minor influence on the thermal conductivity, and that in general the thermal conductivity increases with increasing framework density of the zeolite.     

Path-Integral Calculation of Cross Second Virial Coefficients for Hydrogen Isotopologues

The path-integral Monte Carlo technique and a recent high-accuracy six-dimensional potential are used to compute the cross second virial coefficients for all unlike pairs among the hydrogen isotopologues $\mathrm{H}_{2}, \mathrm{D}_{2}, \mathrm{T}_{2}$ H 2 , D 2 , T 2 , HD, HT, and DT. Values are calculated from 15 K to 2000 K for these quantities where experimental information is almost completely absent. It is found that the commonly assumed arithmetic mean of the pure-component values does not provide a good approximation for the cross coefficients below approximately 50 K, especially for pairs containing $\mathrm{H}_{2}$ H 2 .