Molecular Bands Research Articles

Development of Drying Methodology for Intact Whole Buffalo Liver, Its Characterization, Shelf Life, and Evaluation of Palatability as Pet Treat

Globally, large quantity of animal byproducts is generated from the slaughter of food animals, but there is lack of research articles related to drying of these byproducts and its use as pet food. Therefore, this study was conducted with the aim of utilization of intact whole buffalo liver by drying for pet treat, evaluating its shelf life and palatability. The intact liver surface was superficially sliced, and the surface was pierced. Thereafter, the livers were pretreated in 3% sugar and 4% salt solution (1 : 3 w/v) for 3 h followed by microwaving for 4 min and hot air drying at 60°C for 40 h (designated as T2L). The livers which were dried the same as T2L except surface piercing were referred as T1L, whereas the livers dried only using hot air oven were referred as control (CL). The moisture and protein contents of the dried CL and T2L were found to be 28.46% and 14.29% and 43.85% and 52.76%, respectively. Sodium dodecyl sulphate–polyacrylamide gel electrophoresis (SDS-PAGE) image of T2L revealed the presence of few low as well as high molecular weight protein bands which were absent in CL and T1L indicating a comparatively lower level of protein degradation in T2L. The shelf life of T1L and T2L samples based on microbiological and lipid oxidation analyses was found to be more than 60 days at 25 and 4°C. Palatability studies using dogs showed that all dried samples were highly palatable. Thus, it could be concluded that intact buffalo liver could be dried using surface slicing, with/without piercing followed by salt and sugar pretreatment, 4 min microwaving, and hot air drying at 60°C for 40 h. Future study should focus on the sensory properties such as aroma, texture, and flavor and sensory analysis of the dried liver by human.

Ab Initio Modeling of Mixed-Dimensional Heterostructures: A Path Forward.

Understanding the electronic structure of mixed-dimensional heterostructures is essential for maximizing their application potential. However, accurately modeling such interfaces is challenging due to the complex interplay between the subsystems. We employ a computational framework integrating first-principles methods, including GW, density functional theory (DFT), and the polarizable continuum model, to elucidate the electronic structure of mixed-dimensional heterojunctions formed by free-base phthalocyanines and monolayer molybdenum disulfide. We assess the impact of dielectric screening across various scenarios, from isolated molecules to organic films on a substrate-supported monolayer. Our findings show that while polarization effects cause significant renormalization of molecular energy levels, band energies and alignments in the most relevant setup can be accurately predicted through DFT simulations of the individual subsystems. Additionally, we analyze orbital hybridization, revealing potential pathways for interfacial charge transfer. This study offers new insights into hybrid inorganic/organic interfaces and provides a practical computational protocol suitable for scaled-up studies.

GOALS-JWST: Mid-infrared Molecular Gas Excitation Probes the Local Conditions of Nuclear Star Clusters and the Active Galactic Nucleus in the LIRG VV 114

The enormous increase in mid-IR sensitivity and spatial and spectral resolution provided by the JWST spectrographs enables, for the first time, detailed extragalactic studies of molecular vibrational bands. This opens an entirely new window for the study of the molecular interstellar medium in luminous infrared galaxies (LIRGs). We present a detailed analysis of rovibrational bands of gas-phase CO, H2O, C2H2, and HCN toward the heavily obscured eastern nucleus of the LIRG VV 114, as observed by NIRSpec and the medium resolution spectrograph on the Mid-InfraRed Instrument (MIRI MRS). Spectra extracted from apertures of 130 pc in radius show a clear dichotomy between the obscured active galactic nucleus (AGN) and two intense starburst regions. We detect the 2.3 μm CO bandheads, characteristic of cool stellar atmospheres, in the star-forming regions, but not toward the AGN. Surprisingly, at 4.7 μm, we find highly excited CO (T ex ≈ 700–800 K out to at least rotational level J = 27) toward the star-forming regions, but only cooler gas (T ex ≈ 200 K) toward the AGN. We conclude that only mid-infrared pumping through the rovibrational lines can account for the equilibrium conditions found for CO and H2O in the deeply embedded starbursts. Here, the CO bands probe regions with an intense local radiation field inside dusty young massive star clusters or near the most massive young stars. The lack of high-excitation molecular gas toward the AGN is attributed to geometric dilution of the intense radiation from the bright point source. An overview of the relevant excitation and radiative transfer physics is provided in an appendix.

PDRs4All

Context. The James Webb Space Telescope (JWST) has captured the most detailed and sharpest infrared (IR) images ever taken of the inner region of the Orion Nebula, the nearest massive star formation region, and a prototypical highly irradiated dense photo-dissociation region (PDR). Aims. We investigate the fundamental interaction of far-ultraviolet (FUV) photons with molecular clouds. The transitions across the ionization front (IF), dissociation front (DF), and the molecular cloud are studied at high-angular resolution. These transitions are relevant to understanding the effects of radiative feedback from massive stars and the dominant physical and chemical processes that lead to the IR emission that JWST will detect in many Galactic and extragalactic environments. Methods. We utilized NIRCam and MIRI to obtain sub-arcsecond images over ~150″ and 42″ in key gas phase lines (e.g., Pa α, Br α, [FeII] 1.64 µm, H2 1−0 S(1) 2.12 µm, 0–0 S(9) 4.69 µm), aromatic and aliphatic infrared bands (aromatic infrared bands at 3.3–3.4 µm, 7.7, and 11.3 µm), dust emission, and scattered light. Their emission are powerful tracers of the IF and DF, FUV radiation field and density distribution. Using NIRSpec observations the fractional contributions of lines, AIBs, and continuum emission to our NIRCam images were estimated. A very good agreement is found for the distribution and intensity of lines and AIBs between the NIRCam and NIRSpec observations. Results. Due to the proximity of the Orion Nebula and the unprecedented angular resolution of JWST, these data reveal that the molecular cloud borders are hyper structured at small angular scales of ~0.1–1″ (~0.0002–0.002 pc or ~40–400 au at 414 pc). A diverse set of features are observed such as ridges, waves, globules and photoevaporated protoplanetary disks. At the PDR atomic to molecular transition, several bright features are detected that are associated with the highly irradiated surroundings of the dense molecular condensations and embedded young star. Toward the Orion Bar PDR, a highly sculpted interface is detected with sharp edges and density increases near the IF and DF. This was predicted by previous modeling studies, but the fronts were unresolved in most tracers. The spatial distribution of the AIBs reveals that the PDR edge is steep and is followed by an extensive warm atomic layer up to the DF with multiple ridges. A complex, structured, and folded H0/H2 DF surface was traced by the H2 lines. This dataset was used to revisit the commonly adopted 2D PDR structure of the Orion Bar as our observations show that a 3D “terraced” geometry is required to explain the JWST observations. JWST provides us with a complete view of the PDR, all the way from the PDR edge to the substructured dense region, and this allowed us to determine, in detail, where the emission of the atomic and molecular lines, aromatic bands, and dust originate. Conclusions. This study offers an unprecedented dataset to benchmark and transform PDR physico-chemical and dynamical models for the JWST era. A fundamental step forward in our understanding of the interaction of FUV photons with molecular clouds and the role of FUV irradiation along the star formation sequence is provided.

Structural and functional properties of whey protein isolate-inulin conjugates prepared with ultrasound or wet heating method.

Whey protein isolate (WPI) generally represents poor functional properties such as thermal stability, emulsifying activity and antioxidant activity near its isoelectric point or high temperatures, which limit its application in the food industry. The preparation of WPI-polysaccharide covalent conjugates based on Maillard reaction is a promising method to improve the physical and chemical stability and functional properties of WPI. In this research, WPI-inulin conjugates were prepared through wet heating method and ultrasound method and their structural and functional properties were examined. In conjugates, the free amino acid content was reduced, the high molecular bands were emerged at sodium dodecyl sulfate-polyacrylamide gel electrophoresis (SDS-PAGE), new C-N bonds were formed in Fourier-transform infrared (FTIR) spectroscopy, and fluorescence intensity was reduced compared with WPI. Furthermore, the result of circular dichroism (CD) spectroscopy also showed that the secondary structure of conjugates was changed. Conjugates with ultrasound treatment had better structural properties compared with those prepared by wet heating treatment. The functional properties such as thermal stability, emulsifying activity index (EAI), emulsion stability (ES) and antioxidant activity of conjugates with wet heating treatment were significantly improved compared with WPI. The EAI and ES of conjugates with ultrasound treatment were the highest, but the thermal stability and antioxidant activity were only close to that of the conjugates with wet heating treatment for 2 h. This study revealed that WPI-inulin conjugates prepared with ultrasound or wet heating method not only changed the structural characteristics of WPI but also could promote its functional properties including thermal stability, EAI, ES and antioxidant activity. © 2024 Society of Chemical Industry.

Post-AGB candidate IRAS 02143+5852: Cepheid-like variability, three-layer circumstellar dust envelope and spectral features

ABSTRACT We present the results of multicolour UBVRCICJHK photometry, spectroscopic analysis and spectral energy distribution (SED) modelling for the post-AGB candidate IRAS 02143+5852. We detected Cepheid-like light variations with the full peak-to-peak amplitude ΔV ∼ 0.9 mag and the pulsation period of about 24.9 d. The phased light curves appeared typical for the W Vir Cepheids. The period–luminosity relation for the Type II Cepheids yielded the luminosity logL/L⊙ ∼ 2.95. From a low-resolution spectrum, obtained at maximum brightness, the following atmospheric parameters were determined: Teff ∼ 7400 K and logg ∼ 1.38. This spectrum contains the emission lines H α, ${\rm Ba\, {\small II}}$ λ6496.9, ${\rm He\, {\small I}}$λ10830, and Pa β. Spectral monitoring performed in 2019–2021 showed a significant change in the H α profile and appearance of CH and CN molecular bands with pulsation phase. The metal lines are weak. Unlike typical W Vir variables, the star shows a strong excess of infrared radiation associated with the presence of a heavy dust envelope around the star. We modelled the SED using our photometry and archival data from different catalogues and determined the parameters of the circumstellar dust envelope. We conclude that IRAS 02143+5852 is a low-luminosity analogue of dusty RV Tau stars.

Abstract 44: A novel, codon-based method to modulate off-tumor toxicity of chimeric antigen receptor (CAR) T cells

Abstract Chimeric antigen receptor (CAR) T cell therapies for hematologic malignancies, while promising and efficacious, can also result in a variety of adverse effects. Of note, on-target, off-tumor toxicity is one adverse effect that continues to limit the safety and efficacy of CAR-T cells and has even led to life-threatening or fatal outcomes in patients (Morgan et al. 2010.). To address this, we have developed a unique, codon-based approach by replacing strategically selected codons within CAR non-antigen binding domains with their rare synonymous isoforms. Hoekema et al. (1987) reported the ability of synonymous rare codons to alter gene and protein expression in other model systems. In CAR-T cells, we aim to use this novel, codon-based approach to fine tune and modulate CAR-T cell expression and function to elicit full on-tumor activity while lessening off-tumor toxicity. In our approach, we replaced specific endogenous codons within the non-antigen binding domains of Hu8F4-CAR, a TCR-like 2nd generation CAR developed by our group which targets the leukemia-associated antigen PR1/HLA-A2 (Ma et al. 2016.). Briefly, we created variants of Hu8F4-CAR containing rare codon substitutions in two subtypes: intracellular-based (type 1) and combined extracellular- and intracellular-based (type 2). Each variant subtype (type 1 or 2) had either between 6 and 30 or 27 and 57 rare codons introduced, respectively. Expression profiling and functional assessment of the Hu8F4-CAR variants was assessed in the Jurkat mutant cell line (J.RT3-T3.5) or human primary healthy peripheral blood mononuclear cells (PBMCs) that were enriched for T cells, respectively. Expression profiling results show that surface expression is reduced in J.RT3-T3.5 cells when assessed by flow cytometry by 1-1.5-fold compared to unmodified Hu8F4-CAR. When evaluated by immunoblotting, novel lower molecular weight bands emerge only in rare codon-modified variants, suggesting that rare codons may have altered translational or post-translational processing leading to truncated CAR protein isoforms (30, 45, or 60kDa vs 73kDa for unmodified Hu8F4-CAR), which may contribute to reduced cell surface CAR expression. Furthermore, we have conducted in vitro functional testing of the rare codon-modified variants and show reduced activity against non-malignant off-tumor targets that express PR1 and/or HLA-A2 including healthy donor PBMCs, mobilized hematopoietic cells, and bone marrow. Importantly, in addition to reduced off-tumor activity against healthy myeloid cells, rare codon-modified variants preserve their activity against on-tumor target cells, including the U937-A2+ cell line and primary acute myeloid leukemia. Altogether, these results suggest that our approach can modulate CAR expression and functionality creating a novel methodology to reduce the likelihood of off-tumor adverse effects typically associated with CAR therapies. Citation Format: Rolando A. Vedia, Sijie Lu, Anne V. Philips, Anna Sergeeva, Lisa S. St John, Karen Clise-Dwyer, Gheath Alatrash, Jeffrey J. Molldrem. A novel, codon-based method to modulate off-tumor toxicity of chimeric antigen receptor (CAR) T cells [abstract]. In: Proceedings of the American Association for Cancer Research Annual Meeting 2024; Part 1 (Regular Abstracts); 2024 Apr 5-10; San Diego, CA. Philadelphia (PA): AACR; Cancer Res 2024;84(6_Suppl):Abstract nr 44.

Medium-resolution 0.97–5.3 μm Spectra of Very Young Benchmark Brown Dwarfs with NIRSpec on Board the James Webb Space Telescope

Spectra of young benchmark brown dwarfs with well-known ages are vital to characterize other brown dwarfs, for which ages are in general not known. These spectra are also crucial to test atmospheric models, which have the potential to provide detailed information about the atmospheres of these objects. However, to test atmospheric models optimally, medium-resolution, long-wavelength-coverage spectra with well-understood uncertainties are ideal, such as the spectra provided by the NIRSpec instrument on board the James Webb Space Telescope. In this paper, we present medium-resolution JWST/NIRSpec spectra of two young brown dwarfs, TWA 28 (M9.0) and TWA 27A (M9.0), and one planetary-mass object, TWA 27B (L6.0), members of the TW Hydrae Association (age ∼ 10 Myr). We show the richness of the atomic lines and molecular bands present in the spectra. All objects show signs of a circumstellar disk, via a near-infrared excess and/or via emission lines. We matched a set of cloudless atmospheric spectra (ATMO), and cloudy atmospheric spectra (BT-Settl) to our NIRSpec spectra, and analyzed which wavelength ranges and spectral features both models reproduce best. Both models derive consistent parameters for the three sources, and predict the existence of CH4 at 3.35 μm in TWA 27B. Nonetheless, in contrast to other slightly older objects with similar spectral type, like PSO 318.5–22 and VHS 1256b, this feature is not present in the spectrum of TWA 27B. The lack of the CH4 feature might suggest that the L–T transition of very young dwarfs starts at later spectral types than for older brown dwarfs.

Inactivation of lipase and lipoxygenase in whole wheat flour using atmospheric cold plasma and steam treatments: Kinetics, mechanism, and impact on its compositional properties

This study aims to utilize two separate techniques, viz., atmospheric cold plasma (voltage: 5–25 kV; time: 1–10 min) and steam treatments (at 100 °C for 1–4 min), to inactivate lipase and lipoxygenase in whole wheat flour (WWF) and assess the impact on its compositional properties. The cold plasma exposure of WWF at 25 kV/6 min resulted in 97.5% and 100% inactivation in lipase and lipoxygenase activity, respectively, whereas corresponding inactivation values after the steam treatment (100 °C/4 min) were 90.6% and 99.7%. The inactivation order (n) of lipase and lipoxygenase during cold plasma treatment was 1.2 and 1.0, respectively. In the optical emission spectra of cold plasma-induced air, the band heads within 328–426 nm confirmed the transition between various reactive nitrogen species (second positive, first negative, second positive, and mono-positive systems). The band-head for OH radicals was recorded at 314 nm. The oxygen molecular band at 739 nm and singlet oxygen transition line at 778 nm were also observed. The cold plasma and steam treatments resulted in a more random coil in lipase's secondary structure. The cold plasma treatment at 25 kV/6 min didn't impact the particle size, density, color profile, and proximate composition of the flour.

The role of carbon in red giant spectro-seismology

ABSTRACT Although red clump stars function as reliable standard candles, their surface characteristics (i.e. Teff, log g, and [Fe/H]) overlap with those of red giant branch stars, which are not standard candles. Recent results have revealed that spectral features containing carbon (e.g. CN molecular bands) carry information correlating with the ‘gold-standard’ asteroseismic classifiers that distinguish red clump from red giant branch stars. However, the underlying astrophysical processes driving the correlation between these spectroscopic and asteroseismic quantities in red giants remain inadequately explored. This study aims to enhance our understanding of this ‘spectro-seismic’ effect by refining the list of key spectral features predicting red giant evolutionary state. In addition, we conduct further investigation into those key spectral features to probe the astrophysical processes driving this connection. We employ the data-driven The Cannon algorithm to analyse high-resolution (R ∼ 80 000) Veloce Rosso spectra from the Anglo-Australian Telescope for 301 red giant stars (where asteroseismic classifications from the TESS mission are known for 123 of the stars). The results highlight molecular spectroscopic features, particularly those containing carbon (e.g. CN), as the primary indicators of the evolutionary states of red giant stars. Furthermore, by investigating CN isotopic pairs (that is, 12C14N and 13C14N), we find suggestions of statistically significant differences in the reduced equivalent widths of such lines, suggesting that physical processes that change the surface abundances and isotopic ratios in red giant stars, such as deep mixing, are the driving forces of the ‘spectro-seismic’ connection of red giants.

Quantum mechanical analysis of halogen-based ionic liquid crystal [C12MIM.X(where X = Cl, Br)] molecules

ABSTRACT The electrical and non-linear optical characteristics of 1-dodecyl 3-methyl-imidazolium chloride (C12MIM.Cl or DDMIM.Cl) and 1-dodecyl 3-methyl-imidazolium bromide (C12MIM.Br or DDMIM.Br) ionic liquid crystals for optoelectronic devices were investigated in this study utilising B3LYP method and 6-311++G(d,p) basis set with Gaussian09 software. The majority of ionic liquid crystal research to date has been experiment-driven, with very few theoretical studies on the material's optical characteristics. Additional understanding of the behaviour of ionic liquid crystals is revealed through molecular spectroscopic research. The electronic properties (molecular energy band gap, electrostatic potential map and HOMO–LUMO orbitals) and spectroscopic (IR, UV) characteristics were assessed with the aid of a theoretical/computational model at B3LYP/6-311++G(d,p), whereas a nonlinear optical (NLO) study was carried out using the B3LYP and M06-2X methods with 6-31G(d) and 6-311++G(d,p) basis sets. Results demonstrate reasonable nonlinear optical characteristics in these molecules.

Spectroscopic investigation of early light emission from anode-initiated surface flashover in vacuum

Time-resolved optical emission spectroscopy is used to explore the early development of anode-initiated flashover in vacuum. An experimental apparatus for collecting flashover self-luminosity is introduced, which enables spatially resolved light collection from regions adjacent to the anode and cathode triple junctions. The emitted light is spectrally and temporally resolved utilizing an imaging spectrograph and a fast electronic shutter camera. The first light detectable from flashovers across both Rexolite and polytetrafluoroethylene (PTFE) insulators begins less than 10 ns prior to the flashover gap's impedance collapse and consists of faint broadband feature in primarily visible wavelengths. This suggests luminosity due to excitation in the solid, possibly occurring as a result of field emitted electrons. In the few nanoseconds leading up to and including the impedance collapse, the broadband spectrum grows in intensity and extends into the UV, eventually accompanied by a few emission lines of the insulator material. This is strong evidence that the early stages of anode-initiated flashover include surface layer breakdown of the insulator, as a contrast from cathode-initiated flashover, which is predominately an above-surface process. Spectra accumulated over longer exposures of PTFE flashovers indicate that, in the first few hundred nanoseconds after the impedance collapse, ions from the insulator material constitute the majority of the emission lines. Later, neutral and ionic metal species from the electrode contribute with similar prominence as well as molecular bands from diatomic carbon. Finally, a comparison is provided of the results of these studies to other spectroscopic investigations of vacuum flashover from the literature.

Semiconductor Band Structure, Symmetry, and Molecular Interface Hybridization for the Chemist.

Merging molecular bonding concepts with semiconductor- and materials-based concepts of band structure is challenging due to the mutually exclusive historical development and notations used in those respective fields: symmetry adapted linear combinations (SALCs) and Mulliken terms for molecules, versus k space and Bloch sums for materials. This lack of commonality brings the issue of hybridization (aka electronic coupling) between molecules and materials to the forefront in many aspects of modern chemical research─including nanocrystal properties, solar energy conversion, and molecular computing. It is thus critical to establish a holistic approach to hybridizing orbital (molecule) and plane-wave (semiconductor/material) systems to better describe symmetry-based molecule|material bonding and the corresponding symmetry-adapted molecular orbital (MO) diagrams. Such a unified approach would enable the construction of testable hypotheses about the role of symmetry and electronic structure in determining the extent of electronic coupling between molecular orbitals and semiconductor band structure. This Perspective provides an analysis and compendium of "translations" between the physics and chemistry language of group theory. In this vein, this approach describes the symmetries─and corresponding point groups─that occur in k space along the available descent in symmetry pathways (k space vectors). As a result, chemists may arrive at a more intuitive understanding of the band symmetries of semiconductors, as well as insights into the corresponding algebraic formulations. This analysis can ultimately generate MO diagrams for hybrid molecule|material systems. Lastly, an Outlook provides some context to the application of this analysis to modern problems at the interface of molecular and materials chemistry.

Aqueous humor TGFβ and fibrillin-1 in Tsk mice reveal clues to POAG pathogenesis

Aqueous humor (AH) and blood levels of transforming growth factor β (TGFβ) are elevated in idiopathic primary open angle glaucoma (POAG) representing a disease biomarker of unclear status and function. Tsk mice display a POAG phenotype and harbor a mutation of fibrillin-1, an important regulator of TGFβ bioavailability. AH TGFβ2 was higher in Tsk than wild-type (WT) mice (by 34%; p = 0.002; ELISA); similarly, AH TGFβ2 was higher in human POAG than controls (2.7-fold; p = 0.00005). As in POAG, TGFβ1 was elevated in Tsk serum (p = 0.01). Fibrillin-1 was detected in AH from POAG subjects and Tsk mice where both had similar levels relative to controls (p = 0.45). 350 kDa immunoblot bands representing WT full-length fibrillin-1 were present in human and mouse AH. A 418 kDa band representing mutant full-length fibrillin-1 was present only in Tsk mice. Lower molecular weight fibrillin-1 antibody-reactive bands were present in similar patterns in humans and mice. Certain bands (130 and 32 kDa) were elevated only in human POAG and Tsk mice (p ≤ 0.04 relative to controls) indicating discrete isoforms relevant to disease. In addition to sharing a phenotype, Tsk mice and human POAG subjects had common TGFβ and fibrillin-1 features in AH and also blood that are pertinent to understanding glaucoma pathogenesis.

JWST/NIRCam Transmission Spectroscopy of the Nearby Sub-Earth GJ 341b

We present a JWST/Near Infrared Camera (NIRCam) transmission spectrum from 3.9 to 5.0 μm of the recently validated sub-Earth GJ 341b (R P = 0.92 R ⊕, T eq = 540 K) orbiting a nearby bright M1 star (d = 10.4 pc, K mag = 5.6). We use three independent pipelines to reduce the data from the three JWST visits and perform several tests to check for the significance of an atmosphere. Overall, our analysis does not uncover evidence of an atmosphere. Our null hypothesis tests find that none of our pipelines’ transmission spectra can rule out a flat line, although there is weak evidence for a Gaussian feature in two spectra from different pipelines (at 2.3 and 2.9σ). However, the candidate features are seen at different wavelengths (4.3 μm versus 4.7 μm), and our retrieval analysis finds that different gas species can explain these features in the two reductions (CO2 at 3.1σ compared to O3 at 2.9σ), suggesting that they are not real astrophysical signals. Our forward-model analysis rules out a low-mean-molecular-weight atmosphere (<350× solar metallicity) to at least 3σ, and disfavors CH4-dominated atmospheres at 1–3σ, depending on the reduction. Instead, the forward models find our transmission spectra are consistent with no atmosphere, a hazy atmosphere, or an atmosphere containing a species that does not have prominent molecular bands across the NIRCam/F444W bandpass, such as a water-dominated atmosphere. Our results demonstrate the unequivocal need for two or more transit observations analyzed with multiple reduction pipelines, alongside rigorous statistical tests, to determine the robustness of molecular detections for small exoplanet atmospheres.

Structures Of Dust and gAs (SODA): Constraining the innermost dust properties of II Zw96 with JWST observations of H2O and CO

We analyze JWST NIRSpec+MIRI/MRS observations of the infrared (IR) gas-phase molecular bands of the most enshrouded source (D1) within the interacting system and luminous IR galaxy II Zw 096. We report the detection of rovibrational lines of H2O ν2 = 1 − 0 (∼5.3–7.2 μm) and 12CO ν = 1 − 0 (∼4.45–4.95 μm) in D1. The CO band shows the R- and P-branches in emission and the spectrum of the H2O band shows the P-branch in emission and the R-branch in absorption. The H2O R-branch in absorption unveils an IR-bright embedded compact source in D1 and the CO broad component features a highly turbulent environment. From both bands, we also identified extended intense star-forming (SF) activity associated with circumnuclear photodissociation regions (PDRs), consistent with the strong emission of the ionised 7.7 μm polycyclic aromatic hydrocarbon band in this source. By including the 4.5–7.0 μm continuum information derived from the H2O and CO analysis, we modelled the IR emission of D1 with a dusty torus and SF component. The torus is very compact (diameter of ∼3 pc at 5 μm) and characterised by warm dust (∼370 K), giving an IR surface brightness of ∼3.6 × 108 L⊙ pc−2. This result suggests the presence of a dust-obscured active galactic nucleus (AGN) in D1, which has an exceptionally high covering factor that prevents the direct detection of AGN emission. Our results open a new way to investigate the physical conditions of inner dusty tori via modelling the observed IR molecular bands.

Properties and characteristics of the nanosecond discharge developing at the water–air interface: tracking evolution from a diffused streamer to a spark filament

The characteristics of nanosecond discharge propagating along the water–air interface in a unique dielectric-barrier discharge (DBD)-like configuration with coplanar electrodes submerged in deionised (DI)/tap water are studied by combining ultrafast imaging and emission spectra with electrical characteristics. Time-resolved images provide a clear signature of streamer channels excited on the water surface at either side of the blade (insulated plastic separating the anode/cathode) and propagating perpendicularly away from it towards the anode/cathode with different velocities. Later on, the streamer channels convert into a few discrete and bright discharge channels due to ionisation instability (spark phase). There is no distinctive dependence on water conductivity in the streamer phase, as the optical emission spectroscopy and images of discharges only showed an increase of the luminosity and no significant changes in morphology. However, in the spark phase, more numerous, brighter, and thicker filaments form in tap water. The time-resolved emission spectra reveal the dominance of the first and second positive system of N2 molecular bands in the streamer phase, followed by the appearance of atomic lines of hydrogen, nitrogen, and oxygen in the spark phase. The emission spectra are utilised to estimate several important parameters (gas temperature, reduced electric field ( E/N ), and electron density ( ne )). The streamer phase is characterised by a low gas temperature and a peak E/N amplitude between 700 and 850 Td. On the other hand, the subsequent spark phase is characterised by a gas temperature of ∼400/1100 K and a free electron density up to ne∼1017 –1018 cm−3 in DI/tap water.

Mass spectrometric study of low energy Cs+ ion-induced sputtered fragmentation of PADC polymer.

In this study, low-energy cesium (Cs+ ) ion-induced sputtered fragmentation of poly allyl diglycol carbonate (PADC) was investigated using mass spectrometry. The collision-induced dissociation mechanism revealed emission of various fragments, including monoatomic (H- , C1 - , O1 - ), diatomic (C2 - ), and multiatomic (C3 - , CO2 - , C2 O2 - , C3 O2 - ) species within the Cs+ ion energy range of 1-5keV. The anion current of these fragments exhibited a linear increase with rising incident Cs+ ion energy, indicating a corresponding rise in fragment abundance. Analysis of normalized yield indicated that at 1keV incident energy, the dominant fragment was monoatomic hydrogen (H- ), followed by diatomic carbon (C2 - ), monoatomic carbon (C1 - ), and monoatomic oxygen (O1 - ). Although C2 - remained dominant up to 5keV, other fragments exhibited varying normalized yields at different ion energy steps. The sputter yield estimation revealed that monoatomic hydrogen (H- ) and diatomic carbon (C2 - ) exhibited the highest yields, increasing exponentially beyond 3keV, while multiatomic fragments like C3 - , CO2 - , C2 O2 - , and C3 O2 - displayed the lowest yields. The sputter dissociation mechanism pointed to dehydrogenation, chain scission, and bond breakage as the primary processes during low-energy Cs+ ion impact. Postsputtering Scanning Electron Mircoscope (SEM) micrographs show craters, pits, and micropores on the PADC surface, indicating significant surface degradation. X-ray Diffraction (XRD) spectra exhibited reduced diffraction intensity, while Fourier Transform Infrared Spectroscopy (FTIR) analysis indicated the absence of molecular bands in the IR spectrum, confirming extensive surface damage due to Cs+ ion-induced sputtering.

JWST detection of extremely excited outflowing CO and H2O in VV 114 E SW: A possible rapidly accreting IMBH

Mid-infrared (mid-IR) gas-phase molecular bands are powerful diagnostics of the warm interstellar medium. We report the James Webb Space Telescope detection of the CO v = 1 − 0 (4.4 − 5.0 μm) and H2O ν2 = 1 − 0 (5.0 − 7.8 μm) ro-vibrational bands, both in absorption, toward the “s2” core in the southwest nucleus of the merging galaxy VV 114 E. All ro-vibrational CO lines up to Jlow = 33 (Elow ≈ 3000 K) are detected, as well as a forest of H2O lines up to 130, 13 (Elow ≈ 2600 K). The highest-excitation lines are blueshifted by ∼180 km s−1 relative to the extended molecular cloud, which is traced by the rotational CO (J = 3 − 2) 346 GHz line observed with the Atacama Large Millimeter/submillimeter Array. The bands also show absorption in a low-velocity component (blueshifted by ≈30 km s−1) with lower excitation. The analysis shows that the bands are observed against a continuum with an effective temperature of Tbck ∼ 550 K extinguished with τ6 μmext ∼ 2.5−3 (Ak ∼ 6.9 − 8.3 mag). The high-excitation CO and H2O lines are consistent with v = 0 thermalization with Trot ≈ 450 K and column densities of NCO ≈ (1.7 − 3.5)×1019 cm−2 and NH2O ≈ (1.5 − 3.0)×1019 cm−2. Thermalization of the v = 0 levels of H2O requires either an extreme density of nH2 ≳ 109 cm−3, or radiative excitation by the mid-IR field in a very compact (&lt; 1 pc) optically thick source emitting ∼1010 L⊙. The latter alternative is favored, implying that the observed absorption probes the very early stages of a fully enshrouded active black hole (BH). On the basis of a simple model for BH growth and applying a lifetime constraint to the s2 core, an intermediate-mass BH (IMBH, MBH ∼ 4.5 × 104 M⊙) accreting at super-Eddington rates is suggested, where the observed feedback has not yet been able to break through the natal cocoon.

Fecal-adherent mucus is a non-invasive source of primary human MUC2 for structural and functional characterization in health and disease

The O-glycoprotein Mucin-2 (MUC2) forms the protective colon mucus layer. While animal models have demonstrated the importance of Muc2, few studies have explored human MUC2 in similar depth. Recent studies have revealed that secreted MUC2 is bound to human feces. We hypothesized human fecal MUC2 (HF-MUC2) was accessible for purification and downstream structural and functional characterization. We tested this via histologic and quantitative imaging on human fecal sections; extraction from feces for proteomic and O-glycomic characterization; and functional studies via growth and metabolic assays in vitro. Quantitative imaging of solid fecal sections showed a continuous mucus layer of varying thickness along human fecal sections with barrier functions intact. Lectin profiling showed HF-MUC2 bound several lectins but was weak to absent for Ulex europaeus 1 (α1,2 fucose-binding) and Sambucus nigra agglutinin (α2,6 sialic acid-binding), and did not have obvious b1/b2 barrier layers. HF-MUC2 separated by electrophoresis showed high molecular weight glycoprotein bands (∼1-2 MDa). Proteomics and Western analysis confirmed the enrichment of MUC2 and potential MUC2-associated proteins in HF-MUC2 extracts. MUC2 O-glycomics revealed diverse fucosylation, moderate sialylation, and little sulfation vs. porcine colonic MUC2 and murine fecal Muc2. O-glycans were functional and supported the growth of Bacteroides thetaiotaomicron (B. theta) and short-chain fatty acid (SCFA) production in vitro. MUC2 could be similarly analyzed from inflammatory bowel disease stools, which displayed an altered glycomic profile and differential growth and SCFA production by B. theta vs. healthy samples. These studies describe a new non-invasive platform for human MUC2 characterization in health and disease.