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1. Characterizing the fundamental bending vibration of a linear polyatomic molecule for symmetry violation searches

   https://doi.org/10.1088/1367-2630/ace471  

   Jadbabaie, Arian; Takahashi, Yuiki; Pilgram, Nickolas H; Conn, Chandler J; Zeng, Yi; Zhang, Chi; Hutzler, Nicholas R (July 2023, New Journal of Physics)

   Abstract Polyatomic molecules have been identified as sensitive probes of charge-parity violating and parity violating physics beyond the Standard Model (BSM). For example, many linear triatomic molecules are both laser-coolable and have parity doublets in the ground electronic $\tilde{X}{}^2{\mathrm{\Sigma }}^{+}\left(010\right)$state arising from the bending vibration, both features that can greatly aid BSM searches. Understanding the $\tilde{X}{}^2{\mathrm{\Sigma }}^{+}\left(010\right)$state is a crucial prerequisite to precision measurements with linear polyatomic molecules. Here, we characterize the fundamental bending vibration of ${}^{174}$YbOH using high-resolution optical spectroscopy on the nominally forbidden $\tilde{X}{}^2{\mathrm{\Sigma }}^{+}\left(010\right)$ $\to \tilde{A}{}^2{\mathrm{\Pi }}_{1/2}\left(000\right)$transition at 588 nm. We assign 39 transitions originating from the lowest rotational levels of the $\tilde{X}{}^2{\mathrm{\Sigma }}^{+}\left(010\right)$state, and accurately model the state’s structure with an effective Hamiltonian using best-fit parameters. Additionally, we perform Stark and Zeeman spectroscopy on the $\tilde{X}{}^2{\mathrm{\Sigma }}^{+}\left(010\right)$state and fit the molecule-frame dipole moment to $D_{\mathrm{m}\mathrm{o}\mathrm{l}}=2.16\left(1\right)$Dand the effective electrong-factor to $g_S=2.07\left(2\right)$. Further, we use an empirical model to explain observed anomalous line intensities in terms of interference from spin–orbit and vibronic perturbations in the excited $\tilde{A}{}^2{\mathrm{\Pi }}_{1/2}\left(000\right)$state. Our work is an essential step toward searches for BSM physics in YbOH and other linear polyatomic molecules. 

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2. The EDGE-CALIFA Survey: Spatially Resolved ¹³ CO(1–0) Observations and Variations in ¹² CO(1–0)/ ¹³ CO(1–0) in Nearby Galaxies on Kiloparsec Scales

   https://doi.org/10.3847/1538-4365/acd840  

   Cao, Yixian; Wong, Tony; Bolatto, Alberto D; Leroy, Adam K; Rosolowsky, Erik; Utomo, Dyas; Sánchez, Sebastián F; Barrera-Ballesteros, Jorge K; Levy, Rebecca C; Colombo, Dario; et al (August 2023, The Astrophysical Journal Supplement Series)

   Abstract We present¹³CO(J= 1 → 0) observations for the EDGE-CALIFA survey, which is a mapping survey of 126 nearby galaxies at a typical spatial resolution of 1.5 kpc. Using detected¹²CO emission as a prior, we detect¹³CO in 41 galaxies via integrated line flux over the entire galaxy and in 30 galaxies via integrated line intensity in resolved synthesized beams. Incorporating our CO observations and optical IFU spectroscopy, we perform a systematic comparison between the line ratio ${\mathit{}}_{12/13}\equiv I{[}^{12}\mathrm{CO}(J=1\to 0)\left]/I{[}^{13}\mathrm{CO}\right(J=1\to 0\left)\right]$and the properties of the stars and ionized gas. Higher ${\mathit{}}_{12/13}$values are found in interacting galaxies compared to those in noninteracting galaxies. The global ${\mathit{}}_{12/13}$slightly increases with infrared colorF₆₀/F₁₀₀but appears insensitive to other host-galaxy properties such as morphology, stellar mass, or galaxy size. We also present azimuthally averaged ${\mathit{}}_{12/13}$profiles for our sample up to a galactocentric radius of 0.4r₂₅(∼6 kpc), taking into account the¹³CO nondetections by spectral stacking. The radial profiles of ${\mathit{}}_{12/13}$are quite flat across our sample. Within galactocentric distances of 0.2r₂₅, the azimuthally averaged ${\mathit{}}_{12/13}$increases with the star formation rate. However, Spearman rank correlation tests show the azimuthally averaged ${\mathit{}}_{12/13}$does not strongly correlate with any other gas or stellar properties in general, especially beyond 0.2r₂₅from the galaxy centers. Our findings suggest that in the complex environments in galaxy disks, ${\mathit{}}_{12/13}$is not a sensitive tracer for ISM properties. Dynamical disturbances, like galaxy interactions or the presence of a bar, also have an overall impact on ${\mathit{}}_{12/13}$, which further complicates the interpretations of ${\mathit{}}_{12/13}$variations. 

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3. On the simultaneous reconstruction of the nonlinearity coefficient and the sound speed in the Westervelt equation

   https://doi.org/10.1088/1361-6420/aceef2  

   Kaltenbacher, Barbara; Rundell, William (August 2023, Inverse Problems)

   Abstract This paper considers the Westervelt equation, one of the most widely used models in nonlinear acoustics, and seeks to recover two spatially-dependent parameters of physical importance from time-trace boundary measurements. Specifically, these are the nonlinearity parameter $\kappa \left(x\right)$often referred to as $B/A$in the acoustics literature and the wave speed $c_0\left(x\right)$. The determination of the spatial change in these quantities can be used as a means of imaging. We consider identifiability from one or two boundary measurements as relevant in these applications. For a reformulation of the problem in terms of the squared slowness $\mathfrak{s}=1/c_0^2$and the combined coefficient $\eta =\frac{\kappa }{c_0^2}$we devise a frozen Newton method and prove its convergence. The effectiveness (and limitations) of this iterative scheme are demonstrated by numerical examples. 

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4. Acceleration and Spectral Redistribution of Cosmic Rays in Radio-jet Shear Flows

   https://doi.org/10.3847/1538-4357/acfda9  

   Webb, G. M.; Xu, Y.; Biermann, P. L.; Al-Nussirat, S.; Mostafavi, P.; Li, G.; Barghouty, A. F.; Zank, G. P. (November 2023, The Astrophysical Journal)

   Abstract A steady-state, semi-analytical model of energetic particle acceleration in radio-jet shear flows due to cosmic-ray viscosity obtained by Webb et al. is generalized to take into account more general cosmic-ray boundary spectra. This involves solving a mixed Dirichlet–Von Neumann boundary value problem at the edge of the jet. The energetic particle distribution functionf₀(r,p) at cylindrical radiusrfrom the jet axis (assumed to lie along thez-axis) is given by convolving the particle momentum spectrum $f_0(\infty ,p\prime )$with the Green’s function $G(r,p;p\prime )$, which describes the monoenergetic spectrum solution in which $f_0\to \delta (p-p\prime )$asr→ ∞ . Previous work by Webb et al. studied only the Green’s function solution for $G(r,p;p\prime )$. In this paper, we explore for the first time, solutions for more general and realistic forms for $f_0(\infty ,p\prime )$. The flow velocityu=u(r)e_zis along the axis of the jet (thez-axis).uis independent ofz, andu(r) is a monotonic decreasing function ofr. The scattering time $\tau {(r,p)={\tau }_0\left(p/p_0\right)}^{\alpha }$in the shear flow region 0 <r<r₂, and $\tau {(r,p)={\tau }_0\left(p/p_0\right)}^{\alpha }{\left(r/r_2\right)}^s$, wheres> 0 in the regionr>r₂is outside the jet. Other original aspects of the analysis are (i) the use of cosmic ray flow lines in (r,p) space to clarify the particle spatial transport and momentum changes and (ii) the determination of the probability distribution ${\psi }_p(r,p;p\prime )$that particles observed at (r,p) originated fromr→ ∞ with momentum $p\prime$. The acceleration of ultrahigh-energy cosmic rays in active galactic nuclei jet sources is discussed. Leaky box models for electron acceleration are described. 

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5. Computation of the expectation value of the spin operator ${\hat{S}}^2$ for the spin-flip Bethe–Salpeter equation

   https://doi.org/10.1088/2516-1075/ad48ed  

   Barker, B A; Seshappan, A; Strubbe, D A (May 2024, Electronic Structure)

   Abstract Spin-flip (SF) methods applied to excited-state approaches like the Bethe–Salpeter equation allow access to the excitation energies of open-shell systems, such as molecules and defects in solids. The eigenstates of these solutions, however, are generally not eigenstates of the spin operator ${\hat{S}}^2$. Even for simple cases where the excitation vector is expected to be, for example, a triplet state, the value of $⟨{\hat{S}}^2⟩$may be found to differ from 2.00; this difference is called ‘spin contamination’. The expectation values $⟨{\hat{S}}^2⟩$must be computed for each excitation vector, to assist with the characterization of the particular excitation and to determine the amount of spin contamination of the state. Our aim is to provide for the first time in the SF methods literature a comprehensive resource on the derivation of the formulas for $⟨{\hat{S}}^2⟩$as well as its computational implementation. After a brief discussion of the theory of the SF Bethe–Salpeter equation (BSE) and some examples further illustrating the need for calculating $⟨{\hat{S}}^2⟩$, we present the derivation for the general equation for computing $⟨{\hat{S}}^2⟩$with the eigenvectors from an SF-BSE calculation, how it is implemented in a Python script, and timing information on how this calculation scales with the size of the SF-BSE Hamiltonian. 

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