Molecular Emission Research Articles

Structure, variability, and origin of the low-latitude nightglow continuum between 300 and 1800 nm: evidence for HO2 emission in the near-infrared

Abstract. The Earth's mesopause region between about 75 and 105 km is characterised by chemiluminescent emission from various lines of different molecules and atoms. This emission was and is important for the study of the chemistry and dynamics in this altitude region at nighttime. However, our understanding is still very limited with respect to molecular emissions with low intensities and high line densities that are challenging to resolve. Based on 10 years of data from the astronomical X-shooter echelle spectrograph at Cerro Paranal in Chile, we have characterised in detail this nightglow (pseudo-)continuum in the wavelength range from 300 to 1800 nm. We studied the spectral features, derived continuum components with similar variability, calculated climatologies, studied the response to solar activity, and even estimated the effective emission heights. The results indicate that the nightglow continuum at Cerro Paranal essentially consists of only two components, which exhibit very different properties. The main structures of these components peak at 595 and 1510 nm. While the former was previously identified as the main peak of the FeO “orange arc” bands, the latter is a new discovery. Laboratory data and theory indicate that this feature and other structures between about 800 and at least 1800 nm are caused by emission from the low-lying A′′ and A′ states of HO2. In order to test this assumption, we performed runs with the Whole Atmosphere Community Climate Model (WACCM) with modified chemistry and found that the total intensity, layer profile, and variability indeed support this interpretation, where the excited HO2 radicals are mostly produced from the termolecular recombination of H and O2. The WACCM results for the continuum component that dominates at visual wavelengths show good agreement for FeO from the reaction of Fe and O3. However, the simulated total emission appears to be too low, which would require additional mechanisms where the variability is dominated by O3. A possible (but nevertheless insufficient) process could be the production of excited OFeOH by the reaction of FeOH and O3.

Off-nuclear H2O maser and dense molecular gas in NGC 1068

ABSTRACT The results of high-resolution spectral-line observations of dense molecular gas are presented towards the nuclear region of the type 2 Seyfert galaxy NGC 1068. MERLIN observations of the 22 GHz H2O maser were made for imaging the known off-nuclear maser emission at radio jet component located about 0.3 arcsec north-east of the radio nucleus in the galaxy. High angular resolution ALMA observations have spatially resolved the molecular gas emissions of HCN and HCO+ in this region. The off-nuclear maser spots are found to nearly overlap with a ring-like molecular gas structure and are tracing an evolving shock-like structure, which appears to be energized by interaction between the radio jet and circumnuclear medium. The scenario of the dynamic jet–ISM interaction is further supported by a systematic shift of the centroid velocities of the off-nuclear maser features over a period of 35 yr. The enhanced integrated flux ratios of the HCN to HCO+ line emission features at component C suggest a kinetic temperature Tk ≳ 300 K and an H2 density of ≳ 106 cm−3, which are conditions where water masers may be formed. The diagnostics of the masering action in this jet–ISM interaction region is exemplary for galaxies hosting off-nuclear H2O maser emission.

Discriminating organic carbon from endokarstic moonmilk-type deposits by LIBS. The case of a natural carbonated Martian analogue

Moonmilk-type deposits exemplify carbonated Martian analogues existing in the subsurface of Earth, an endokarstic speleothem with a possible biochemical origin composed principally by carbonates, mainly huntite and dolomite. In this work, samples of moonmilk located in Nerja Cave (southern Spain) have been studied by LIBS with the aim of identifying carbon of biogenic origin by establishing a relationship between a molecular emission indicator, CN signal, and the organic carbon content. The characterization of this kind of carbonate deposit with a multiple mineralogical composition has been completed using scanning electron microscopy (SEM), energy dispersive X-ray (EDX) and X-ray diffraction techniques for qualitative and semi-quantitative analysis. The information attained from LIBS regarding energy thresholds and time-resolved kinetics of CN emissions provides useful insight into the identification of different molecular emitters, namely organic and inorganic CN, depending on the laser irradiance and time settings conditions. These promising results are of application in the search and identification of biosignatures in upcoming planetary missions with astrobiological purposes.

Compensating isotope effect on molecular emission of hydroxyl and imidogen isotopologues in laser-induced plasma

BackgroundThe molecular isotopologues in laser-induced plasma exhibit riddling emission behaviors in terms of wavelength, intensity, and temporal evolution of spectra due to the isotope effect. Although this phenomenon introduces uncertainty to isotope analyses based on molecular spectra, its underlying mechanism remains undisclosed. ResultsIn this study, laser-induced breakdown spectroscopy (LIBS) is employed to identify the emission behavior of hydrogen, oxygen, and nitrogen isotopologues in a plasma plume. The goal is to discern the details of the isotope effect and mitigate resulting uncertainty. The molecular emissions of hydroxyl (OH) and imidogen (NH) were measured from plasma ablated on isotopically enriched water samples. Time-resolved detection clearly reveals distinct isotopic disparities in intensity variation and optimum gate delay, which were attributed to plasma thermo-hydrodynamics. Lighter isotopologues exhibit earlier and faster associations than their heavier counterparts due to their fast reaction rates and expansion velocities. The extent of the isotope effect hinged on plasma characteristics governed by measurement conditions. Consequently, comparing spectral intensity between molecular isotopologues cannot directly indicate the nominal isotope abundance of the sample. To address it, a compensation strategy has been devised, quantifying isotope effects through parameters like the slope and optimum delay of time-resolved detection. The approach successfully predicts nominal isotope abundance using compensated intensity ratios, with an absolute bias of less than 3 %. SignificanceThis study not only offered fundamental insights into the isotope effect in laser-induced plasma but also proposed an alternative method for isotope quantification that circumvents complicated calibration processes.

Optical Spectroscopy of Comets

Comets are pristine remnants of the Solar system, composed of dust and ice. They remain inactive and undetectable for most of their orbit due to low temperatures. However, as they approach the Sun, volatile materials sublimate, expelling dust and creating a visible coma. Spectroscopic observations of comets help the simultaneous study of both the gas emissions and reflected sunlight from dust particles. By implementing a long slit, the spatial variations in molecular emissions can be analysed to be further used for other computations. Additionally, spatial information aids in extracting the characteristic profile of the Afρ parameter, revealing insights into the behaviour of dust emissions. A sufficiently long slit would prove advantageous in extracting information about the emissions occurring at different parts of the coma or even the tail. We can gain an overall comprehensive understanding of a comet’s chemical composition and dust emission by constructively utilising low-resolution spectroscopy with the help of a long slit.

Collagen type I PET/MRI enables evaluation of treatment response in pancreatic cancer in pre-clinical and first-in-human translational studies.

Pancreatic ductal adenocarcinoma (PDAC) is an invasive and rapidly progressive malignancy. A major challenge in patient management is the lack of a reliable imaging tool to monitor tumor response to treatment. Tumor-associated fibrosis characterized by high type I collagen is a hallmark of PDAC, and fibrosis further increases in response to neoadjuvant chemoradiotherapy (CRT). We hypothesized that molecular positron emission tomography (PET) using a type I collagen-specific imaging probe, 68Ga-CBP8 can detect and measure changes in tumor fibrosis in response to standard treatment in mouse models and patients with PDAC. Methods: We evaluated the specificity of 68Ga-CBP8 PET to tumor collagen and its ability to differentiate responders from non-responders based on the dynamic changes of fibrosis in nude mouse models of human PDAC including FOLFIRNOX-sensitive (PANC-1 and PDAC6) and FOLFIRINOX-resistant (SU.86.86). Next, we demonstrated the specificity and sensitivity of 68Ga-CBP8 to the deposited collagen in resected human PDAC and pancreas tissues. Eight male participant (49-65 y) with newly diagnosed PDAC underwent dynamic 68Ga-CBP8 PET/MRI, and five underwent follow up 68Ga-CBP8 PET/MRI after completing standard CRT. PET parameters were correlated with tumor collagen content and markers of response on histology. Results: 68Ga-CBP8 showed specific binding to PDAC compared to non-binding 68Ga-CNBP probe in two mouse models of PDAC using PET imaging and to resected human PDAC using autoradiography (P < 0.05 for all comparisons). 68Ga-CBP8 PET showed 2-fold higher tumor signal in mouse models following FOLFIRINOX treatment in PANC-1 and PDAC6 models (P < 0.01), but no significant increase after treatment in FOLFIRINOX resistant SU.86.86 model. 68Ga-CBP8 binding to resected human PDAC was significantly higher (P < 0.0001) in treated versus untreated tissue. PET/MRI of PDAC patients prior to CRT showed significantly higher 68Ga-CBP8 uptake in tumor compared to pancreas (SUVmean: 2.35 ± 0.36 vs. 1.99 ± 0.25, P = 0.036, n = 8). PET tumor values significantly increased following CRT compared to untreated tumors (SUVmean: 2.83 ± 0.30 vs. 2.25 ± 0.41, P = 0.01, n = 5). Collagen deposition significantly increased in response to CRT (59 ± 9% vs. 30 ± 9%, P=0.0005 in treated vs. untreated tumors). Tumor and pancreas collagen content showed a positive direct correlation with SUVmean (R2 = 0.54, P = 0.0007). Conclusions: This study demonstrates the specificity of 68Ga-CBP8 PET to tumor type I collagen and its ability to differentiate responders from non-responders based on the dynamic changes of fibrosis in PDAC. The results highlight the potential use of collagen PET as a non-invasive tool for monitoring response to treatment in patients with PDAC.

Porous titanium scaffolds modified with Zeolitic Imidazolate Framework (ZIF-8) with enhanced osteogenic activity for the prevention of implant-associated infections.

In this study, zeolitic imidazolate framework 8 (ZIF-8) was coated on porous Ti6Al4V scaffolds, either bare or previously modified using hydroxyapatite (HA) or HA and gelatin (HAgel), via a growing single-step method in aqueous media using two contact times at 6h and 24h. The coated scaffolds termed ZIF-8@Ti, ZIF-8@HA/Ti, and ZIF-8@HAgel/Ti were characterized via scanning electron microscopy (SEM), powder X-ray diffraction (PXRD), attenuated total reflectance-Fourier transform infrared (ATR-FTIR), and molecular plasma-atomic emission spectroscopy (MP-AES). In order to assess the cell proliferation rate, the cytocompatibility of the scaffolds was evaluated in primary osteoblasts (hOBs) using alamarBlue assay, while the osteoconductivity was analyzed in hOBs using a real-time approach, evaluating the expression of secreted phosphoprotein 1 (SPP1). Osteopontin, which is the protein encoded by this gene, represents the major non-collagenous bone protein that binds tightly to HA. The scaffolds were shown to be non-cytotoxic based on hOB proliferation at all time points of analysis (24h and 72h). In hOB cultures, the scaffolds induced the upregulation of SPP1 with different fold changes. Some selected scaffolds were assayed in vitro for their antibacterial potential against Staphylococcus epidermidis; the scaffolds coated with ZIF-8 crystals, regardless of the presence of HA and gelatin, strongly inhibited bacterial adhesion to the materials and reduced bacterial proliferation in the culture medium, demonstrating the suitable release of ZIF-8 in a bioactive form. These experiments suggest that the innovative scaffolds, tested herein, provide a good microenvironment for hOB adhesion, viability, and osteoconduction with effective prevention of S. epidermidis adhesion.

Hydrocarbon chemistry in the inner regions of planet-forming disks

Context. The analysis of the mid-infrared spectra helps understanding the composition of the gas in the inner, dense and warm terrestrial planet forming region of disks around young stars. ALMA has detected hydrocarbons in the outer regions of the planet forming disk and Spitzer detected C2H2 in the inner regions. JWST-MIRI provides high spectral resolution observations of C2H2 and a suite of more complex hydrocarbons are now reported. Interpreting the fluxes observed in the spectra is challenging and radiation thermo-chemical codes are needed to properly take into account the disk structure, radiative transfer, chemistry and thermal balance. Various disk physical parameters like the gas-to-dust ratio, dust evolution including radial drift, dust growth and settling can affect the fluxes observed in the mid-IR. Still, thermo-chemical disk models were not always successful in matching all observed molecular emission bands simultaneously. Aims. The goal of this project is two-fold. Firstly, we analyse the warm carbon chemistry in the inner regions of the disk, namely within 10 au, to find pathways forming C2H2 potentially missing from the existing chemical networks. Secondly, we analyse the effect of the new chemistry on the line fluxes of acetylene. Methods. We used the radiative thermo-chemical disk code called PRODIMO to expand the hydrocarbon chemistry that occurs in a typical standard T Tauri disks. We used the UMIST and the KIDA rate databases for collecting reactions for the species. We included a number of three-body and thermal decomposition reactions from the STAND2020 network. We also included isotopomers for the species that were present in the databases. The chemistry was then analysed in the regions that produce observable features in the mid-infrared spectra. We studied the effect of expanding the hydrocarbon chemistry on the mid-infrared spectra. Results. Acetylene is formed via two pathways in the surface layers of disks: neutral-neutral and ion-neutral. They proceed via the hydrogenation of C or C+, respectively. Thus, the abundances of C, C+, H and H2 affect the formation of C2H2. Therefore, also the formation of H2 indirectly affects the abundance of acetylene. Chemisorbed H is more efficient in forming H2 compared to physisorbed H at warm temperatures and hence increases the abundance of C2H2. Conclusions. We provide a new extended warm chemical network that considers up to eight carbon atom long species, while also taking into account different isotopomers and can form the building blocks of PAHs: C6H6. For a standard T Tauri disk with a canonical value of gas-to-dust mass, the line fluxes increase only by a factor of less than 2. JWST is now detecting hydrocarbons such as methane, acetylene, and C4H2 in disks with a high C/O ratio. Hence, this new extended warm hydrocarbon network will aid in interpreting the observed mid-infrared fluxes.

A survey of molecular line emission towards Herbig Be star V645 Cyg

ABSTRACT We present a survey of molecular line emission towards the molecular cloud surrounding Herbig Be star V645 Cyg. The survey was performed with the 20-m Onsala space telescope at 3 and 4 mm. We detected emission lines of 33 molecules and their isotopologues from diatomic molecules to four COMs up to seven atoms. Using detected lines, we estimated molecular column densities and abundances relative to molecular hydrogen in local thermodynamic equilibrium (LTE) approximation for all molecules except for methanol, for which we obtained physical parameters using a non-LTE model. Moreover, in the basement of the non-LTE model of methanol line emission, we consider that there is a weak maser effect in the additional spectral component of 51–40 E methanol line at 84.521 GHz. We compared the molecular abundances with values found in several astrochemical templates: molecular clouds, hot cores, and photodissociation regions, and found that signatures of these different types can be found towards V645 Cyg. We also obtained maps of the cloud in several molecular emission lines. The peaks of CO and CH3OH emission are shifted from the direction of the star, but the CS, HCO+, HNC, HCN, and N2H+ emission peaks are observed directly towards the star. Exploring the gas kinematics around V645 Cyg, we found that velocity structure in the ambient molecular cloud on the scale ≈1.6–2.0 pc is not the same as within ≈0.5 pc found previously by other authors.

PRODAN Photophysics as a Tool to Determine the Bilayer Properties of Different Unilamellar Vesicles Composed of Phospholipids.

Vesicles formed by phospholipids are promising candidates for drug delivery. It is known that the lipid composition affects properties such as the rigidity-fluidity of the membrane and that it influences the bilayer permeability, but sometimes sophisticated techniques are selected to monitor them. In this work, we study the bilayer of different unilamellar vesicles composed of different lipids (1,2-dioleoyl-sn-glycero-3-phosphocholine, DOPC, and lecithin) and diverse techniques such as extruder and electrospun templates and using 6-propionyl-2-(N,N-dimethyl) aminonaphthalene (PRODAN) and its photophysics. Moreover, we were able to monitor the influence of cholesterol on the bilayers. We demonstrate that the bilayer properties can be evaluated using the emission feature of the molecular probe PRODAN. This fluorescent probe gives relevant information on the polarity and fluidity of the microenvironment for unilamellar vesicles formed by two different methods. The PRODAN emission at 434 nm suggests that the bilayer properties significantly change if DOPC or lecithin is used in the vesicle preparation especially in their fluidity. Moreover, cholesterol induces alterations in the bilayer's structural and microenvironmental properties to a greater or lesser degree in both vesicles. Thus, we propose an easy and elegant way to evaluate physicochemical properties, which is fundamental for manufacturing vesicles as a drug delivery system, simply by monitoring the molecular probe emission band centered at 434 nm, which corresponds to the PRODAN species deep inside the bilayer.

Hyphenated liquid electrode glow discharge-dielectric barrier discharge molecular emission spectrometry for determination of dithiocarbamates.

A hyphenated liquid electrode glow discharge (LEGD)-dielectric barrier discharge (DBD) molecular emission spectrometer was constructed and used as a novel liquid chromatography (LC) detector for dithiocarbamates (DTC) determination. The LEGD was used as an acidolysis reactor for the in-situ transformation of DTCs into CS2 with high efficiencies of 74.11-97.98%. The DBD was used to excite CS2 gas to generate a specific molecular emission at 257.94nm. The linear correlation coefficient of the method was>0.99 from 1 to 200μgmL-1. The detection limits ranged from 0.1 to 0.3μgmL-1 with 76-119% recovery and relative standard deviations of 0.2-8.5%. Moreover, the hyphenated microplasma spectrometer achieved low power consumption, low temperature, immediate acidolysis, and high transformational efficiency, and can detect each DTC when combined with LC.

Digging into the Interior of Hot Cores with ALMA: Spiral Accretion into the High-mass Protostellar Core G336.01–0.82

We observed the high-mass star-forming core G336.01–0.82 at 1.3 mm and 0.″05 (∼150 au) angular resolution with the Atacama Large Millimeter/submillimeter Array (ALMA) as part of the Digging into the Interior of Hot Cores with ALMA survey. These high-resolution observations reveal two spiral streamers feeding a circumstellar disk at opposite sides in great detail. Molecular line emission from CH3OH shows velocity gradients along the streamers consistent with infall. Similarly, a flattened envelope model with rotation and infall implies a mass larger than 10 M ☉ for the central source and a centrifugal barrier of 300 au. The location of the centrifugal barrier is consistent with local peaks in the continuum emission. We argue that gas brought by the spiral streamers is accumulating at the centrifugal barrier, which can result in future accretion burst events. A total high infall rate of ∼4 × 10−4 M ☉ yr−1 is derived by matching models to the observed velocity gradient along the streamers. Their contribution accounts for 20%–50% the global infall rate of the core, indicating streamers play an important role in the formation of high-mass stars.

Spatio-temporal dynamics of electrons and helium metastables in uniform dielectric barrier discharges formed in He/N2

A uniform atmospheric pressure dielectric barrier discharge is operated in helium with an admixture (0.45%) of nitrogen. The discharge is ignited in the gas gap between a driven and a grounded electrode and propagates along the dielectric surface outside the gap. Plasma conditions are characterised with current and voltage measurements and by application of absolutely calibrated optical emission spectroscopy, with a focus on nitrogen molecular emission. Plasma parameters, namely electron density and reduced electric field, are determined with spatial and temporal resolution in the frame of a collisional-radiative model using a calibrated charge coupled device camera and Abel inversion of measured images. The density of an effective helium metastable state is calculated using the measured plasma parameters and compared with values of the state density measured with tunable diode laser absorption spectroscopy.

JWST: Deuterated PAHs, PAH Nitriles, and PAH Overtone and Combination Bands. I. Program Description and First Look

A first look is taken at the NIRSpec 1–5 μm observations from James Webb Space Telescope program 1591 that targets seven objects along the low-mass stellar life cycle with polycyclic aromatic hydrocarbon (PAH) emission. Spectra extracted from a 1.″5 radius circular aperture are explored, showing a wealth of features, including the 3 μm PAH complex, the PAH continuum, and atomic and molecular emission lines from H i, He, H2, and other species. CO2- and H2O-ice absorption and CO emission is also seen. Focusing on the bright-PDR position in M17, the PAH CH stretch falls at 3.29 μm (FWHM = 0.04 μm). Signs of its 1.68 μm overtone are confused by line emission in all targets. Multicomponent decomposition reveals a possible aliphatic deuterated PAH feature centered at 4.65 μm (FWHM = 0.02 μm), giving [D/H]alip. = 31% ± 12.7%. However, there is little sign of its aromatic counterpart between 4.36 and 4.43 μm. There is also little sign of PAH nitrile emission between 4.34 and 4.39 μm. A PAH continuum rises from ∼1 to 3.2 μm, after which it jumps by about a factor of 2.5 at 3.6 μm, with bumps at 3.8, 4.04, and 4.34 μm adding structure. The CO2 absorption band in M17 is matched with 10:1 H2O:CO2 ice at 10 K. The v = 0 pure rotational molecular hydrogen population diagram reveals >2200 K UV-pumped gas. The hydrogen Pfund series runs from levels 10 to >30. Considering Brα/Brβ = 0.381 ± 0.01966 and Case B recombination results in A V ≃ 8. CO emission in IRAS 21282+5050 originates from 258 K gas. In-depth spectral–spatial analysis of all features and targets is planned for a series of forthcoming papers.

Modelling molecular clouds and CO excitation in AGN-host galaxies

ABSTRACT We present a new physically motivated model for estimating the molecular line emission in active galaxies. The model takes into account (i) the internal density structure of giant molecular clouds (GMCs), (ii) the heating associated with both stars and the active galactic nuclei (AGNs), respectively, producing photodissociation regions (PDRs) and X-ray-dominated regions (XDRs) within the GMCs, and (iii) the mass distribution of GMCs within the galaxy volume. The model needs, as input parameters, the radial profiles of molecular mass, far-UV flux and X-ray flux for a given galaxy, and it has two free parameters: the CO-to-H2 conversion factor αCO, and the X-ray attenuation column density NH. We test this model on a sample of 24 local (z ≤ 0.06) AGN-host galaxies, simulating their carbon monoxide spectral-line energy distribution (CO SLED). We compare the results with the available observations and calculate, for each galaxy, the best (αCO, NH) with a Markov chain Monte Carlo algorithm, finding values consistent with those present in the literature. We find a median αCO = 4.8 M⊙ (K km s−1 pc2)−1 for our sample. In all the modelled galaxies, we find the XDR component of the CO SLED to dominate the CO luminosity from Jupp ≥ 4. We conclude that, once a detailed distribution of molecular gas density is taken into account, PDR emission at mid-/high-J becomes negligible with respect to XDR.

A Low-mass line-rich Core Found in Massive Star-forming Region IRAS 16351-4722

We present Atacama Large Millimeter/submillimeter Array subarcsecond-resolution observations of both continuum and molecular lines at 345 GHz toward the massive star-forming region IRAS 16351-4722 (hereafter I16351). A total of 12 dust cores were detected based on high-spatial-resolution observations of the continuum. Among them, a high-mass core (11.6 M ⊙) and a low-mass core (1.7 M ⊙) show abundant molecular line emissions. 164 molecular transitions from 29 species and 104 molecular transitions from 25 species are identified in the high-mass and low-mass cores, respectively. Complex organic molecules (COMs) such as CH3OH, CH3OCHO, CH3OCH3, C2H5OH, and C2H5CN are detected in the two cores. Under the assumption of local thermodynamic equilibrium, the rotational temperatures and column densities of the COMs are derived with the XCLASS software. The maximum rotation temperature values in the low-mass core and the high-mass core were found to be approximately 130 K and 198 K, respectively. Additionally, the line widths in the high-mass core are larger than those in the low-mass one. The abundant COM line transitions, high gas temperatures, and smaller line widths indicate the presence of a low-mass line-rich core in the massive star formation region for the first time, while the high-mass line-rich core shows hot core properties. When comparing the molecular abundances of CH3OH, CH3OCHO, CH3OCH3, and C2H5OH of the two cores with other hot cores and hot corinos reported in the literature, we further confirm that both a hot core and a low-mass line-rich core are simultaneously detected in I16351.

A theory study based on DFT/TD‐DFT for a series of Ir(III) complexes with the low‐efficiency roll‐off and the high‐inter‐system crossover rate properties

AbstractThis study employs density functional theory (DFT) and time‐dependent density functional theory (TD‐DFT) to investigate a series of cyclometallated Ir(III) complexes for their application as OLED light‐emitting materials, including (dtp)2Ir(dpm), (mmpyp)2Ir(dpm), (dtp)2Ir(tpip), (mmpyp)2Ir(tpip), (dtp)2Ir(pic), and (mmpyp)2Ir(pic). Their geometries, frontier molecular orbital properties, ionization potential, electron affinity, absorption and emission spectra, and spin‐orbit coupling properties have been analyzed respectively. Through comparison, we have identified complexes with reduced efficiency roll‐off and enhanced kISC.

Assessment of the terminal velocity of explosively-propelled metal liner using laser-induced breakdown spectroscopy

ABSTRACT Organic energetic compounds containing aluminum (OECAl) are hazardous materials, which have extensive applications in industries. For military and commercial high explosives, Gurney velocity is the terminal velocity of explosively-propelled metal liner on the bases of the ratio of the mass of metal to the mass of explosive. Due to the high cost of experimental determination of Gurney velocity, it is suitable to have a low-cost experimental method for reliable estimation of Gurney velocity of OECAl. A novel approach is introduced to use laser-induced breakdown spectroscopy (LIBS) as a highly energetic laser pulse to atomize and excite samples (a plasma) for assessment of the Gurney velocity of OECAl. Five compositions of 1,3,5-trinitro-1,3,5-triazine (RDX)-based aluminized explosives are studied through the LIBS technique to detect their atomic and molecular emissions in the air atmosphere. Plasma emissions of these compositions are recorded where the atomic line of Al as well as molecular bands of AlO and CN have the highest intensities at some wavelengths. Intensities of Al (λ = 394.38 and 396.16 nm), CN (λ = 388.29 and 422.70 nm), and AlO (λ = 467.19, 484.25, and 464.84 nm) peaks are correlated with their Gurney velocities. The intensity of Al at 396.16 nm gives the best linear relationship (r2 = 0.981) with the Gurney velocity of OECAl samples.

Highly stable multicolor carbon dots created using o-phenylenediamine and terephthalic acid systems towards flexible emitting films

Multicolor carbon dots (CDs) with high stability are desired for various light emitting devices and bio-images. In this paper, the green and red emitting CDs were created by o-phenylenediamine and terephthalic acid (TA) as precursors at different temperatures via a solvothermal reaction. An efficient response surface methodology is developed to analyze the formation mechanism. Using optimized conditions, the green and red emitting CDs reveal photoluminescence quantum yields (PLQYs) of 34.0 % and 26.8 %, respectively. The result of response surface method indicates that temperature, precursor concentration, and TA amount significantly influence the PLQYs of the CDs. The formation mechanism of the CDs was proposed by analyzing solvatochromism phenomena, oxidation processes, and fluorescence lifetimes. Initially, green CDs with surface state luminescence were formed followed by the subsequent generation of red CDs exhibiting molecular and carbon core state emission during oxidation. These CDs reveal high stability, in which the PL intensity almost remained unchanged after 7 months. Furthermore, three-color CDs/polymer films (λem = 500, 536, and 568 nm) were successfully fabricated by using these two types of CDs. Sample 180-CDs/polystyrene film had photochromic properties, while other films had good photostability.

Medial Temporal Lobe Tau Aggregation Relates to Divergent Cognitive and Emotional Empathy Abilities in Alzheimer's Disease.

In Alzheimer's disease (AD), the gradual accumulation of amyloid-β (Aβ) and tau proteins may underlie alterations in empathy. To assess whether tau aggregation in the medial temporal lobes related to differences in cognitive empathy (the ability to take others' perspectives) and emotional empathy (the ability to experience others' feelings) in AD. Older adults (n = 105) completed molecular Aβ positron emission tomography (PET) scans. Sixty-eight of the participants (35 women) were Aβ positive and symptomatic with diagnoses of mild cognitive impairment, dementia of the Alzheimer's type, logopenic variant primary progressive aphasia, or posterior cortical atrophy. The remaining 37 (22 women) were asymptomatic Aβ negative healthy older controls. Using the Interpersonal Reactivity Index, we compared current levels of informant-rated cognitive empathy (Perspective-Taking subscale) and emotional empathy (Empathic Concern subscale) in the Aβ positive and negative participants. The Aβ positive participants also underwent molecular tau-PET scans, which were used to investigate whether regional tau burden in the bilateral medial temporal lobes related to empathy. Aβ positive participants had lower perspective-taking and higher empathic concern than Aβ negative healthy controls. Medial temporal tau aggregation in the Aβ positive participants had divergent associations with cognitive and emotional empathy. Whereas greater tau burden in the amygdala predicted lower perspective-taking, greater tau burden in the entorhinal cortex predicted greater empathic concern. Tau burden in the parahippocampal cortex did not predict either form of empathy. Across AD clinical syndromes, medial temporal lobe tau aggregation is associated with lower perspective-taking yet higher empathic concern.