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1. Exploring Jahn-Teller distortions: a local vibrational mode perspective

   https://doi.org/10.1007/s00894-024-05882-8  

   Quintano, Mateus; Moura, Renaldo T; Kraka, Elfi (April 2024, Journal of Molecular Modeling)

   AbstractThe characterization of normal mode (CNM) procedure coupled with an adiabatic connection scheme (ACS) between local and normal vibrational modes, both being a part of the Local Vibrational Mode theory developed in our group, can identify spectral changes as structural fingerprints that monitor symmetry alterations, such as those caused by Jahn-Teller (JT) distortions. Employing the PBE0/Def2-TZVP level of theory, we investigated in this proof-of-concept study the hexaaquachromium cation case,$$\mathrm {[Cr{(OH_2)}_6]^{3+}}$$ ${\left[\mathrm{Cr}{\left({\mathrm{OH}}_2\right)}_6\right]}^{3+}$/$$\mathrm {[Cr{(OH_2)}_6]^{2+}}$$ ${\left[\mathrm{Cr}{\left({\mathrm{OH}}_2\right)}_6\right]}^{2+}$, as a commonly known example for a JT distortion, followed by the more difficult ferrous and ferric hexacyanide anion case,$$\mathrm {[Fe{(CN)}_6]^{4-}}$$ ${\left[\mathrm{Fe}{\left(\mathrm{CN}\right)}_6\right]}^{4-}$/$$\mathrm {[Fe{(CN)}_6]^{3-}}$$ ${\left[\mathrm{Fe}{\left(\mathrm{CN}\right)}_6\right]}^{3-}$. We found that in both cases CNM of the characteristic normal vibrational modes reflects delocalization consistent with high symmetry and ACS confirms symmetry breaking, as evidenced by the separation of axial and equatorial group frequencies. As underlined by the Cremer-Kraka criterion for covalent bonding, from$$\mathrm {[Cr{(OH_2)}_6]^{3+}}$$ ${\left[\mathrm{Cr}{\left({\mathrm{OH}}_2\right)}_6\right]}^{3+}$to$$\mathrm {[Cr{(OH_2)}_6]^{2+}}$$ ${\left[\mathrm{Cr}{\left({\mathrm{OH}}_2\right)}_6\right]}^{2+}$there is an increase in axial covalency whereas the equatorial bonds shift toward electrostatic character. From$$\mathrm {[Fe{(CN)}_6]^{4-}}$$ ${\left[\mathrm{Fe}{\left(\mathrm{CN}\right)}_6\right]}^{4-}$to$$\mathrm {[Fe{(CN)}_6]^{3-}}$$ ${\left[\mathrm{Fe}{\left(\mathrm{CN}\right)}_6\right]}^{3-}$we observed an increase in covalency without altering the bond nature. Distinct$$\pi $$ $\pi$back-donation disparity could be confirmed by comparison with the isolated CN$$^-$$ ${}^{-}$system. In summary, our study positions the CNM/ACS protocol as a robust tool for investigating less-explored JT distortions, paving the way for future applications. Graphical abstractThe adiabatic connection scheme relates local to normal modes, with symmetry breaking giving rise to axial and equatorial group local frequencies 

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2. Chiral and counter-propagating Majorana fermions in a p-wave superconductor

   https://doi.org/10.1088/1367-2630/ab5cad  

   Hu, Haiping; Satija, Indubala I.; Zhao, Erhai (December 2019, New Journal of Physics)

   Abstract Chiral and helical Majorana fermions are two archetypal edge excitations in two-dimensional topological superconductors. They emerge from systems of different Altland–Zirnbauer symmetries and characterized by $\mathbb{Z}$and ${\mathbb{Z}}_2$topological invariants respectively. It seems improbable to tune a pair of co-propagating chiral edge modes to counter-propagate in a single system without symmetry breaking. Here, we explore the peculiar behaviors of Majorana edge modes in topological superconductors with an additional ‘mirror’ symmetry which changes the bulk topological invariant to $\mathbb{Z}\oplus \mathbb{Z}$type. A theoretical toy model describing the proximity structure of a Chern insulator and ap_x-wave superconductor is proposed and solved analytically to illustrate a direct transition between two topologically nontrivial phases. The weak pairing phase has two chiral Majorana edge modes, while the strong pairing phase is characterized by mirror-graded Chern number and hosts a pair of counter-propagating Majorana fermions protected by the mirror symmetry. The edge theory is worked out in detail, and implications to braiding of Majorana fermions are discussed. 

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3. Higher-group symmetry of (3+1)D fermionic $$\mathbb{Z}_2$$ gauge theory: Logical CCZ, CS, and T gates from higher symmetry

   https://doi.org/10.21468/SciPostPhys.16.5.122  

   Barkeshli, Maissam; Hsin, Po-Shen; Kobayashi, Ryohei (January 2024, SciPost Physics)

   It has recently been understood that the complete global symmetry of finite group topological gauge theories contains the structure of a higher-group. Here we study the higher-group structure in (3+1)D\mathbb{Z}_2 ${\mathbb{Z}}_2$gauge theory with an emergent fermion, and point out that pumping chiralp+ip $p+ip$topological states gives rise to a\mathbb{Z}_{8} ${\mathbb{Z}}_8$0-form symmetry with mixed gravitational anomaly. This ordinary symmetry mixes with the other higher symmetries to form a 3-group structure, which we examine in detail. We then show that in the context of stabilizer quantum codes, one can obtain logical CCZ and CS gates by placing the code on a discretization ofT^3 $T^3$(3-torus) andT^2 \rtimes_{C_2} S^1 $T^2{⋊}_{C_2}{S}^1$(2-torus bundle over the circle) respectively, and pumpingp+ip $p+ip$states. Our considerations also imply the possibility of a logicalT $T$gate by placing the code on\mathbb{RP}^3 ${ℝ\mathbb{P}}^3$and pumping ap+ip $p+ip$topological state. 

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4. Power coupling losses for misaligned and mode-mismatched higher-order Hermite–Gauss modes

   https://doi.org/10.1364/OL.426999  

   Tao, Liu; Kelley-Derzon, Jessica; Green, Anna_C; Fulda, Paul (May 2021, Optics Letters)

   This paper analytically and numerically investigates misalignment and mode-mismatch-induced power coupling coefficients and losses as a function of Hermite–Gauss (HG) mode order. We show that higher-order HG modes are more susceptible to beam perturbations when, for example, coupling into optical cavities: the misalignment and mode-mismatch-induced power coupling losses scale linearly and quadratically with respect to the mode indices, respectively. As a result, the mode-mismatch tolerance for the ${\mathrm{H}\mathrm{G}}_{3,3}$mode is reduced to a factor of 0.28 relative to the currently used ${\mathrm{H}\mathrm{G}}_{0,0}$mode. This is a potential hurdle to using higher-order modes to reduce thermal noise in future gravitational-wave detectors. 

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5. The NANOGrav 15 yr Data Set: Chromatic Gaussian Process Noise Models for Six Pulsars

   https://doi.org/10.3847/1538-4357/ad5291  

   Larsen, Bjorn; Mingarelli, Chiara_M_F; Hazboun, Jeffrey_S; Chalumeau, Aurélien; Good, Deborah_C; Simon, Joseph; Agazie, Gabriella; Anumarlapudi, Akash; Archibald, Anne_M; Arzoumanian, Zaven; et al (August 2024, The Astrophysical Journal)

   Abstract Pulsar timing arrays (PTAs) are designed to detect low-frequency gravitational waves (GWs). GWs induce achromatic signals in PTA data, meaning that the timing delays do not depend on radio frequency. However, pulse arrival times are also affected by radio-frequency-dependent “chromatic” noise from sources such as dispersion measure (DM) and scattering delay variations. Furthermore, the characterization of GW signals may be influenced by the choice of chromatic noise model for each pulsar. To better understand this effect, we assess if and how different chromatic noise models affect the achromatic noise properties in each pulsar. The models we compare include existing DM models used by the North American Nanohertz Observatory for Gravitational waves (NANOGrav) and noise models used for the European PTA Data Release 2 (EPTA DR2). We perform this comparison using a subsample of six pulsars from the NANOGrav 15 yr data set, selecting the same six pulsars as from the EPTA DR2 six-pulsar data set. We find that the choice of chromatic noise model noticeably affects the achromatic noise properties of several pulsars. This is most dramatic for PSR J1713+0747, where the amplitude of its achromatic red noise lowers from ${\log }_{10}{A}_{\mathrm{RN}}=-{14.1}_{-0.1}^{+0.1}$to $-{14.7}_{-0.5}^{+0.3}$, and the spectral index broadens from ${\gamma }_{\mathrm{RN}}={2.6}_{-0.4}^{+0.5}$to ${\gamma }_{\mathrm{RN}}={3.5}_{-0.9}^{+1.2}$. We also compare each pulsar's noise properties with those inferred from the EPTA DR2, using the same models. From the discrepancies, we identify potential areas where the noise models could be improved. These results highlight the potential for custom chromatic noise models to improve PTA sensitivity to GWs. 

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