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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 1,747 records · Page 97
All sourcesNASA NTRSDOE OSTI
DOE OSTI2017

Distortion of Digital Image Correlation (DIC) Displacements and Strains from Heat Waves

“Heat waves” is a colloquial term used to describe convective currents in air formed when different objects in an area are at different temperatures. In the context of Digital Image Correlation (DIC) and other optical-based image processing techniques, imaging an object of interest through heat waves can significantly distort the apparent location and shape of the object. We present that there are many potential heat sources in DIC experiments, including but not limited to lights, cameras, hot ovens, and sunlight, yet error caused by heat waves is often overlooked. This paper first briefly presents three practical situations in which heat waves contributed significant error to DIC measurements to motivate the investigation of heat waves in more detail. Then the theoretical background of how light is refracted through heat waves is presented, and the effects of heat waves on displacements and strains computed from DIC are characterized in detail. Finally, different filtering methods are investigated to reduce the displacement and strain errors caused by imaging through heat waves. The overarching conclusions from this work are that errors caused by heat waves are significantly higher than typical noise floors for DIC measurements, and that the errors are difficult to filter because the temporal and spatial frequencies of the errors are in the same range as those of typical signals of interest. In conclusion, eliminating or mitigating the effects of heat sources in a DIC experiment is the best solution to minimizing errors caused by heat waves.

42 ENGINEERING↗
DOE OSTI2018

Speciation in the Fe(III)-Cl(I)-H 2 O System at 298.15 K, 313.15 K, and 333.15 K (25 °C, 40 °C, and 60 °C)

This article presents the results on speciation of ferric iron generated by the dissolution of chemical reagent hydromolysite (ferric chloride hexahydrate, FeCl 3 :6H 2 O) in water at 298.15 K, 313.15 K, and 333.15 K (25 °C, 40 °C, and 60 °C). Experiments were performed with a thermoregulated system up to the equilibrium point, as manifested by solution pH. Solution samples were analyzed in terms of concentration, pH, and electrical conductivity. Measurements of density and refractive index were obtained at different temperatures and iron concentrations. A decrease of pH was observed with the increase in the amount of dissolved iron, indicating that ferric chloride is a strong electrolyte that reacts readily with water. Experimental results were modeled using the hydrogeochemical code PHREEQC in order to obtain solution speciation. Cations and neutral and anion complexes were simultaneously present in the system at the studied conditions according to model simulations, where dominant species included Cl - , FeCl 2+ , FeCl 2 + , FeOHCl 2 0 , and H + . A decrease in the concentration of Cl - and Fe 3+ ions took place with increasing temperature due to the association of Fe-Cl species. Standard equilibrium constants for the formation of FeOHCl 2 0 obtained in this study were log K f 0 = -0.8 ± 0.01 at 298.15 K (25 °C), -0.94 ± 0.02 at 313.15 K (40 °C), and -1.03 ± 0.01 at 333.15 K (60 °C).

36 MATERIALS SCIENCE↗
DOE OSTI2023

Insights of Boundary Layer Turbulence Over the Complex Terrain of Central Himalaya from GVAX Field Campaign

Limited observations hinder understanding of turbulent characteristics in mountainous terrain resulting from heating or cooling of slopes, wind, vertical motions, and heat or moisture advection, which disperse aerosols and other pollutants over the region. In this study, the 1290 MHz radar wind profiler data are utilized to compute the boundary layer height (BLH), the refractive index structure constant (C n 2 ), and the energy dissipation rate (ε) over the central Himalayan site for the period of November 2011 to March 2012, from the intense Ganges Valley Aerosol Experiment (GVAX) field measurements. The radar wind profiler (RWP) based estimation of BLH and ε is validated against the radiosonde, representing the effectiveness of the datasets for further investigation. The strong seasonal variation of log C n 2 and log ε, with average values of ≈ -12 m -2/3 and -2 m 2 s -3 , respectively, is associated with the mountain-induced local circulations and stability in the atmospheric boundary layer. The weak stratification during weak flow is found to be responsible for deep mixing, particularly in the nocturnal boundary layer in spring. Furthermore, the level of cloud cover significantly impacts the strength of turbulence, with the highest cloud cover resulting in a substantial increase in log C n 2 (approximately -11 m -2/3 ) due to intense updraft and downdraft motions compared to clear skies. Additionally, the distribution of aerosol loading across the site, coupled with the behavior of BLH, atmospheric stability, and orographic-induced circulations, implies distinctive seasonal mechanisms for transporting aerosols toward the mountains. This study offers valuable insights into the diurnal and seasonal patterns of turbulent mixing and the mechanisms behind the transport of pollutants through boundary layer processes over the region.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2023

Using Multiple Geophysical Methods to Refine a Stratigraphic Conceptual Site Model at a Nuclear Waste Site

At contaminated sites, there is a critical reliance on conceptual site models of which a key component is the geologic framework model (GFM), which is used to build predictive fate and transport modeling in support of remediation goals. Here, we detail an ongoing study at a nuclear waste site (Hanford Site, Washington, USA) where surface geophysical methods were used to complement existing borehole information and to help site new boreholes to update and refine the GFM. Ground-based electrical resistivity tomography (ERT), time-domain electromagnetics (TEM), and seismic data was acquired on the Hanford Site’s Central Plateau, where the presence of a hydraulically transmissive subsurface feature, or paleochannel, was suspected but uncertain based on contaminant concentrations at sparsely located boreholes. To assess and compare ERT, TEM, and seismic geophysical datasets, co-located data was acquired in an area where the existing GFM was more certain. Surrounding the suspected paleochannel, ERT and seismic refraction tomography showed similar subsurface structures consistent with a channelized feature. While TEM interpretation was limited in the suspected paleochannel area due to a thick resistive top layer and high electromagnetic noise, TEM showed greater utility in a different area where these factors were less prevalent. Based on the results of quasi-3D ERT inversions, we propose updates to the GFM, including identifying a paleochannel. Further, we evaluate the utility of geophysical methods and examine lessons learned that will be used as a basis for continued characterization efforts to support site management decisions and implementation efforts.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2014

Nonlinear localized modes in PT-symmetric optical media with competing gain and loss

The existence and stability of the nonlinear spatial localized modes are investigated in parity-time symmetric optical media characterized by a generic complex hyperbolic refractive index distribution with competing gain and loss profile. The exact analytical expression of the localized modes are found for all values of the competing parameter and in the presence of both the self-focusing and self-defocusing Kerr nonlinearity. The effects of competing gain/loss profile on the stability structure of these localized modes are discussed with the help of linear stability analysis followed by the direct numerical simulation of the governing equation. The spatial localized modes in two-dimensional geometry as well as the transverse power-flow density associated with these localized modes are also examined. -- Highlights: • Existence of localized modes is investigated in PT-symmetric complex potentials. • Exact analytical expression of the localized modes is obtained. • Effect of gain/loss profile on the stability of these localized modes is discussed. • Localized modes in 2D and associated transverse power-flow density are also examined.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2015

The features of a quantum description of radiation in an optically dense medium

This paper is devoted to the theory of quantum electromagnetic field in an optically dense medium. Self-consistent equations describing interaction between a quantum field and a quantum dielectric medium are obtained from the first principles, i.e., outside a phenomenological description. Using these equations, we found a transformation (of the Bogoliubov transformation type) that converts the operators of the “vacuum” field into operators of collective perturbations of the field and an ensemble of atoms, that is, photons in the medium. Transformation parameter is the refractive index of the wave mode considered. It is shown that besides the energy of the collective electromagnetic field, the energy of photons in the medium includes the energy of the internal degrees of freedom of the substance and the energy of near-field dipole interaction between atoms in the polarized medium. The concept of negative energy photons is introduced on the basis of self-consistent equations. - Highlights: • Quantum equations of field–medium interaction are obtained from the first principles. • Transformation of field operators from vacuum to medium is of Bogoliubov type. • The concept of negative energy photons is introduced.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2015

Modulation of the photonic band structure topology of a honeycomb lattice in an atomic vapor

In an atomic vapor, a honeycomb lattice can be constructed by utilizing the three-beam interference method. In the method, the interference of the three beams splits the dressed energy level periodically, forming a periodic refractive index modulation with the honeycomb profile. The energy band topology of the honeycomb lattice can be modulated by frequency detunings, thereby affecting the appearance (and disappearance) of Dirac points and cones in the momentum space. This effect can be usefully exploited for the generation and manipulation of topological insulators.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2018

Spectral singularities, threshold gain, and output intensity for a slab laser with mirrors

We explore the consequences of the emergence of linear and nonlinear spectral singularities in TE modes of a homogeneous slab of active optical material that is placed between two mirrors. We use the results together with two basic postulates regarding the behavior of laser light emission to derive explicit expressions for the laser threshold condition and output intensity for these modes of the slab and discuss their physical implications. In particular, we reveal the details of the dependence of the threshold gain and output intensity on the position and properties of the mirrors and on the real part of the refractive index of the gain material.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2015

Role of Aquaporin 0 in lens biomechanics

Maintenance of proper biomechanics of the eye lens is important for its structural integrity and for the process of accommodation to focus near and far objects. Several studies have shown that specialized cytoskeletal systems such as the beaded filament (BF) and spectrin-actin networks contribute to mammalian lens biomechanics; mutations or deletion in these proteins alters lens biomechanics. Aquaporin 0 (AQP0), which constitutes ∼45% of the total membrane proteins of lens fiber cells, has been shown to function as a water channel and a structural cell-to-cell adhesion (CTCA) protein. Our recent ex vivo study on AQP0 knockout (AQP0 KO) mouse lenses showed the CTCA function of AQP0 could be crucial for establishing the refractive index gradient. However, biomechanical studies on the role of AQP0 are lacking. The present investigation used wild type (WT), AQP5 KO (AQP5{sup −/−}), AQP0 KO (heterozygous KO: AQP0{sup +/−}; homozygous KO: AQP0{sup −/−}; all in C57BL/6J) and WT-FVB/N mouse lenses to learn more about the role of fiber cell AQPs in lens biomechanics. Electron microscopic images exhibited decreases in lens fiber cell compaction and increases in extracellular space due to deletion of even one allele of AQP0. Biomechanical assay revealed that loss of one or both alleles of AQP0 caused a significant reduction in the compressive load-bearing capacity of the lenses compared to WT lenses. Conversely, loss of AQP5 did not alter the lens load-bearing ability. Compressive load-bearing at the suture area of AQP0{sup +/−} lenses showed easy separation while WT lens suture remained intact. These data from KO mouse lenses in conjunction with previous studies on lens-specific BF proteins (CP49 and filensin) suggest that AQP0 and BF proteins could act co-operatively in establishing normal lens biomechanics. We hypothesize that AQP0, with its prolific expression at the fiber cell membrane, could provide anchorage for cytoskeletal structures like BFs and together they help to confer fiber cell shape, architecture and integrity. To our knowledge, this is the first report identifying the involvement of an aquaporin in lens biomechanics. Since accommodation is required in human lenses for proper focusing, alteration in the adhesion and/or water channel functions of AQP0 could contribute to presbyopia. - Highlights: • AQP0 aids in lens biomechanics. • AQP0 provides lens stiffness. • AQP0 is critical for lens transparency. • AQP0 could play a significant role in lens accommodation in human. • Alteration in the function(s) of lens AQP0 could lead to presbyopia.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2018

Quantitative monitoring of two simultaneously binding species using Label-Enhanced surface plasmon resonance

Highlights: • SPR discriminates and monitors two molecules simultaneously binding to a surface. • Accurate concentration determination of two different molecules simultaneously. • Deconstruction of a sum sensorgram into two molecular component sensorgrams. • Simultaneous measurement of binding constants of two binding molecules in a mixture. • Applicability to allosteric effects, bi-specific binders, and conformation changes. Surface plasmon resonance (SPR) is a well-established method for biomolecular interaction studies. SPR monitors the binding of molecules to a solid surface, embodied as refractive index changes close to the surface. One limitation of conventional SPR is the universal nature of the detection that results in an inability to qualitatively discriminate between different binding species. Furthermore, it is impossible to directly discriminate two species simultaneously binding to different sites on a protein, which limits the utility of SPR, for example, in the study of allosteric binders or bi-specific molecules. It is also impossible in principle to discriminate protein conformation changes from actual binding events. Here we demonstrate how Label-Enhanced SPR can be utilized to discriminate and quantitatively monitor the simultaneous binding of two different species – one dye-labeled and one unlabeled - on a standard, single-wavelength SPR instrument. This new technique increases the versatility of SPR technology by opening up application areas where the usefulness of the approach has previously been limited.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2013

An improved iteration loop for the three dimensional quasi-static particle-in-cell algorithm: QuickPIC

We present improvements to the three-dimensional (3D) quasi-static particle-in-cell (PIC) algorithm, which is used to efficiently model short-pulse laser and particle beam–plasma interactions. In this algorithm the fields including the index of refraction created by a static particle/laser beam are calculated. These fields are then used to advance the particle/laser beam forward in time (distance). For a 3D quasi-static code, calculating the wake fields is done using a two-dimensional (2D) PIC code where the time variable is ξ=ct-z and z is the propagation direction of the particle/laser beam. When calculating the wake, the fields, particle positions and momenta are not naturally time centered so an iterative predictor corrector loop is required. In the previous iterative loop in QuickPIC (currently the only 3D quasi-static PIC code), the field equations are derived using the Lorentz gauge. Here we describe a new algorithm which uses gauge independent field equations. It is found that with this new algorithm, the results converge to the results from fully explicitly PIC codes with far fewer iterations (typically 1 iteration as compared to 2–8) for a wide range of problems. In addition, we describe a new deposition scheme for directly depositing the time derivative of the current that is needed in one of the field equations. The new deposition scheme does not require message passing for the particles inside the iteration loop, which greatly improves the speed for parallelized calculations. Comparisons of results from the new and old algorithms and to fully explicit PIC codes are also presented.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2011

Role of oxygen on the optical properties of borate glass doped with ZnO

Lithium tungsten borate glass (0.56-x)B{sub 2}O{sub 3}-0.4Li{sub 2}O-xZnO-0.04WO{sub 3} (0{<=}x{<=}0.1 mol%) is prepared by the melt quenching technique for photonic applications. Small relative values of ZnO are used to improve the glass optical dispersion and to probe as well the role of oxygen electronic polarizability on its optical characteristics. The spectroscopic properties of the glass are determined in a wide spectrum range (200-2500 nm) using a Fresnel-based spectrophotometric technique. Based on the Lorentz-Lorenz theory, as ZnO content increases on the expense of B{sub 2}O{sub 3} the glass molar polarizability increased due to an enhanced unshared oxide ion 2p electron density, which increases ionicity of the chemical bonds of glass. The role of oxide ion polarizability is explained in accordance with advanced measures and theories such as optical basicity, O 1s binding energy, the outer most cation binding energy in Yamashita-Kurosawa's interionic interaction parameter and Sun's average single bond strength. FT-IR measurements confirm an increase in bridging oxygen bonds, as a result of replacement of ZnO by B{sub 2}O{sub 3}, which increase the UV glass transmission window and transmittance. - Graphical abstract: O1s, Yamashita-Kurosawa's parameter and average single bond strength of charge overlapping between electronic shells are used to explain enhanced oxide ion 2p electron density, which increases refractive index of glasses. Highlights: > New borate glass for photonic application is prepared. > The dispersion property of the glass is effectively controlled using small amounts of ZnO. > ZnO is used to probe the glass structure and investigate the role of oxygen on the obtained optical properties of the glasses. > Modern theories are used to explain enhanced unshared oxide ion 2p electron density, which increases ionicity of chemical bonds of the glass.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2012

Investigation and application of quantitative relationship between sp energy levels of Bi{sup 3+} ion and host lattice

Information on {sup 1}S{sub 0}-{sup 3}P{sub 1} (A band) and {sup 1}S{sub 0}-{sup 1}P{sub 1} (C band) transition energy of Bi{sup 3+} ion in dozens of different compounds has been gathered and analyzed. With the use of the dielectric theory of the chemical bond for complex crystals, relationships between A and C absorption band and environmental factor h{sub e} were established: E{sub A}=2.972+6.206exp (-h{sub e}/0.551); E{sub C}=3.236+10.924exp (-h{sub e}/0.644). For Bi{sup 3+} doped hosts with known structure and refractive index, it is possible to predict Bi{sup 3+} energy level position with an good accuracy of typically {+-}0.51 eV using the two relationships. Moreover, a direct relationship between A and C band was deduced: E{sub C}=3.236+2.290(E{sub A}-2.972){sup 0.856}. Thus a very simple method to predict C band position was proposed. This work will be of great help to understand spectroscopy of Bi{sup 3+} and will be useful for developing new PDP, LED and mercury-free fluorescent lamp phosphors. - Graphical abstract: This figure shows relationship between positions of A band and C band of Bi{sup 3+} ion and environmental factor h{sub e} of host. It establishes the relation between macroscopical spectroscopy of Bi{sup 3+} ion and microcosmic structure of the hosts. Highlights: Black-Right-Pointing-Pointer Relationships between A, C absorption band and environmental factor h{sub e} were established. Black-Right-Pointing-Pointer A direct relation between A and C band was deduced and an easier method to predict C band was given. Black-Right-Pointing-Pointer Positions of C band of Bi{sup 3+} ion in some compounds were predicted using our formula.

36 MATERIALS SCIENCE↗
DOE OSTI2012

Theoretical prediction of the fundamental properties for the ternary Li{sub 2}PtH{sub 6} and Na{sub 2}PtH{sub 6}

Li{sub 2}PtH{sub 6} and Na{sub 2}PtH{sub 6} are good candidate for hydrogen storage. The structural, elastic, electronic and optical properties of Li{sub 2}PtH{sub 6} and Na{sub 2}PtH{sub 6} compounds have been investigated using pseudo-potential plane-wave method based on the density functional theory. Computed lattice constant and H atom positional parameter at equilibrium agree well with the available experimental data. A quadratic pressure dependence of the elastic stiffness is found. A set of isotropic elastic parameters and related properties, namely bulk and shear moduli, Young's modulus, Poisson's ratio, average sound velocity and Debye temperature are numerically estimated in the framework of the Voigt-Reuss-Hill approximation for Li{sub 2}PtH{sub 6} and Na{sub 2}PtH{sub 6} polycrystalline aggregate. The analyses of the band structure indicates that Li{sub 2}PtH{sub 6} and Na{sub 2}PtH{sub 6} are indirect gap semiconductors. The static dielectric constant and static refractive index are inversely proportional to the fundamental gap. Highlights: Black-Right-Pointing-Pointer We predict elastic moduli, energy gaps and optical parameters. Black-Right-Pointing-Pointer Electron effective mass is anisotropic. Black-Right-Pointing-Pointer Li{sub 2}PtH{sub 6} and Na{sub 2}PtH{sub 6} are indirect gap semiconductors. Black-Right-Pointing-Pointer The contribution to the optical spectra from main transitions are predicted.

36 MATERIALS SCIENCE↗
DOE OSTI2014

Structural, electronic and optical properties of novel carbonate fluorides ABCO{sub 3}F (A=K, Rb, Cs; B=Ca, Sr)

In the present study, we performed first principles calculations on the electronic and optical properties of layered alkali–alkaline earth carbonate fluorides which attract attention in the domain of nonlinear optics. The calculated lattice parameters and volumes with and without inclusion of van der Waals (vdW) correction methods to standard density functional methods were compared with experiments. We observed that vdW interactions are predominant in RbCaCO{sub 3}F and CsCaCO{sub 3}F as compared with other computed compounds. The calculated bulk modulus from single crystal elastic constants reveals that these materials are all relatively harder than the KH{sub 2}PO{sub 4} (KDP) crystal. We also found that these materials are wide band gap insulators as obtained from Tran–Blaha modified Becke–Johnson potential. The linear optical properties such as dielectric function, refractive indices, birefringence and absorption spectra are presented. Finally, the calculated birefringence values indicate that these crystals could be promising for producing phase matching in the deep ultra-violet region. - Graphical abstract: The co- and anti-parallel alignment of CO{sub 3} groups leads to larger and smaller SHG coefficients in (a) KCaCO{sub 3}F, (b) KSrCO{sub 3}F, (c) RbSrCO{sub 3}F, (d) RbCaCO{sub 3}F, and (e) CsCaCO{sub 3}F. - Highlights: • Effect of van der Waals interactions on structural properties. • Single-crystalline elastic constants and mechanical stability. • Electronic properties. • Linear optical properties. • Comparison of present computed compounds with other well known materials in non-linear optical materials.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2016

Electronic, elastic, and optical properties of monolayer BC{sub 2}N

The structural stability, electronic structure, elasticity, and optical properties of four types of monolayer BC{sub 2}N have been investigated from first principles using calculation based on density functional theory. The results show that the structural stability of BC{sub 2}N increases with the number of C–C and B–N bonds. By calculating the two-dimensional Young's modulus, shear modulus, Poisson's ratio, and shear anisotropic factors in different directions, four structures present various anisotropies and the most stable structure is almost isotropic. For C-type BC{sub 2}N, the values of two-dimensional Young's modulus, shear modulus, and bulk modulus (309, 128, 195 GPa m{sup −1}), are smaller than those of graphene (343, 151, 208) but bigger than those of h-BN (286, 185, 116). Furthermore, the dielectric function, refractive index, reflectivity, absorption coefficient, and energy loss spectrum are also calculated to investigate the mechanism underpinning the optical transitions in BC{sub 2}N, revealing monolayer BC{sub 2}N as a candidate window material. - Graphical abstract: Schematic diagram of BC{sub 2}N under the biaxial tensile strain. Changes in the valence-band top and the conduction-band bottom of BC{sub 2}N with increasing strain.

36 MATERIALS SCIENCE↗
DOE OSTI2017

Synthesis, growth, structural and optical studies of a new organic three dimensional framework: 4-(aminocarbonyl)pyridine 4-(aminocarbonyl)pyridinium hydrogen L-malate

4-(aminocarbonyl)pyridine 4-(aminocarbonyl)pyridinium hydrogen L-malate [(4ACP)(4ACP).(LM)] a new organic nonlinear optical (NLO) crystal was grown by the slow evaporation method. Single crystal X-ray diffraction analysis revealed that the [(4ACP)(4ACP).(LM)] crystal belongs to monoclinic crystal system, space group P2{sub 1}/n, with a three dimensional network. Thermogravimetry (TG) and differential thermal (DT) analyses showed that [(4ACP)(4ACP).(LM)] is thermally stable up to 165 °C. The optical transmittance window and the lower cut-off wavelength of [(4ACP)(4ACP).(LM)] were found out by UV–vis–NIR spectral study. The molecular structure of [(4ACP)(4ACP).(LM)] was further confirmed by FTIR spectral studies. The relative dielectric permittivity and dielectric loss were determined as function of frequency and temperature. The third order nonlinear optical property of [(4ACP)(4ACP).(LM)] was studied by the Z-scan technique using a 532 nm diode pumped CW Nd:YAG laser. Nonlinear refractive index, nonlinear absorption coefficient and third order nonlinear susceptibility of the grown crystal were found to be 7.38×10{sup −8} cm{sup 2}/W, 0.08×10{sup −4} cm/W and 5.36×10{sup −6} esu, respectively. The laser damage threshold value is found to be 1.75 GW/cm{sup 2} - Graphical abstract: In the crystal structure of the title complex, the asymmetric unit contains one hydrogen L-malate anion, 4-(aminocarbonyl)pyridinium cation and a neutral isonicotinamide molecule. It is stabilized by intermolecular N-H…O, C-H…O and O-H…O hydrogen bonds which generate a three dimensional network.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2018

Influence of Sm2O3 addition on Judd-Ofelt parameters, thermal and optical properties of the TeO2-Li2O-ZnO-Nb2O5 glass system

Highlights: • Synthesis of Sm{sub 2}O{sub 3} doped TeO{sub 2}-Li{sub 2}O-ZnO-Nb{sub 2}O{sub 5} glass to be used in optical devices. • Area under the peak calculations of FTIR and Raman display higher presence of BOs. • DSC plots indicate high stability and high rigidity of prepared glass samples. • Judd-Ofelt analysis shows the ionic nature of Sm{sup 3+} ions with neighboring atoms. • Higher branching ratio values obtained from {sup 6}H{sub 5/2} → {sup 6}F{sub 5/2} emission transition. - Abstract: A series of transparent and light yellow color samples composed of Sm{sub 2}O{sub 3} doped tellurium oxide glasses with chemical composition 75TeO{sub 2}-5Li{sub 2}O-10ZnO-(10-X) Nb{sub 2}O{sub 5}-XSm{sub 2}O{sub 3} was prepared by conventional melt-quenching technique. Rare earth (Sm{sub 2}O{sub 3}) was added to improve all glass properties. From obtained radiative properties, the samples which prepared with above composition can be considered as a prospect application for laser design due to higher branching ratio. The physical properties including sample density, molar volume, and OPD were measured. The glassy nature is approved by XRD analysis. The structural modification of glass forming units with introducing Sm{sub 2}O{sub 3} was studied by FTIR and Raman spectra. The intensity ratio of TeO{sub 4}/TeO{sub 3} was measured to determine the ratio of bridging/non-bridging oxygen exists in glass network. Glass thermal stability, glass transition temperature, and melting temperature were obtained from DSC plots. The UV–vis-NIR absorption spectra display 9 peaks. Optical parameters including optical band gap E{sub Opt}, Urbach energy ΔE and refractive index n were determined. From absorption spectra, Judd-Ofelt intensity parameters (Ω{sub λ} and λ = 2, 4, 6) have been derived to study bonding nature. A spectroscopic quality factor was calculated. Branching ratio (β{sub r}) and lifetime (τ) have been calculated using JO parameters. Absorption and emission cross-sections were determined to measure the probability of an absorption or emission process. Finally, we propose that these prepared samples can be used in optical devices and other applications.

36 MATERIALS SCIENCE↗