Measurement of the Cross Sections of Ξ c 0 and Ξ c + Baryons and of the Branching-Fraction Ratio BR ( Ξ c 0 → Ξ − e + ν e ) / BR ( Ξ c 0 → Ξ − π + ) in p p Collisions at s = 13 TeV
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72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
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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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Evidence of the h c → K S 0 K + π − + c . c . decay
Based on ( 2.712 ± 0.014 ) × 10 9 ψ ( 3686 ) events collected by the BESIII Collaboration, evidence of the hadronic decay h c → K S 0 K + π − + c . c . is found with a significance of 4.3 σ in the ψ ( 3686 ) → π 0 h c process. The branching fraction of h c → K S 0 K + π − + c . c . is measured to be ( 7.3 ± 1.8 ± 0.8 ) × 10 − 4 , where the first and second uncertainties are statistical and systematic, respectively. Combining with the exclusive decay width of η c → K K ¯ π , our result indicates inconsistencies with both pQCD and NRQCD predictions. Published by the American Physical Society 2024
Ablikim, M.↗
A Metal‐Organic Framework with Nonpolar Pore Surfaces for the One‐Step Acquisition of C 2 H 4 from a C 2 H 4 and C 2 H 6 Mixture
Abstract Because C 2 H 4 plays an essential role in the chemical industry, economical and energy‐efficient separation of ethylene (C 2 H 4 ) from ethane (C 2 H 6 ) is extremely important. With the exception of energy‐intensive cryogenic distillation, there are few one‐step methods to obtain polymer‐grade (≥99.95 % pure) C 2 H 4 from C 2 H 4 /C 2 H 6 mixtures. Here we report a highly stable metal‐organic‐framework (MOF) FJI‐H11‐Me(des) (FJI‐H=Hong's group in Fujian Institute of Research on the Structure of Matter) which features one‐dimensional hexagonal nonpolar pore surfaces constructed by aromatic rings and alkyl groups. This FJI‐H11‐Me(des) adsorbs C 2 H 6 rather than C 2 H 4 between 273 and 303 K. Practical breakthrough experiments with C 2 H 4 containing 1 % C 2 H 6 have shown that FJI‐H11‐Me(des) can realize the acquisition in one‐step of polymer‐grade, 99.95 % pure C 2 H 4 under various conditions including different gas flow rates, temperatures and relative humidity.
Di, Zhengyi↗
Measurement of the branching fractions of the decays Λ c + → Λ K S 0 K + , Λ c + → Λ K S 0 π + , and Λ c + → Λ K * +
Studies are performed of the Cabibbo-favored decay Λ c + → Λ K S 0 K + and the singly Cabibbo-suppressed decay Λ c + → Λ K S 0 π + , based on a sample of e + e − collision data, corresponding to an integrated luminosity of 4.5 fb − 1 , accumulated at center-of-mass energies between 4599.53 MeV and 4698.82 MeV with the BESIII detector. The decay Λ c + → Λ K S 0 π + is observed for the first time. The branching fractions of Λ c + → Λ K S 0 K + and Λ c + → Λ K S 0 π + are measured to be ( 3.04 ± 0.30 ± 0.16 ) × 10 − 3 and ( 1.73 ± 0.27 ± 0.10 ) × 10 − 3 , respectively, where the first uncertainties are statistical and the second are systematic. These results correspond to the most precise measurement of these quantities for both decays. Evidence of a K * + contribution in the Λ c + → Λ K S 0 π + decay is found with a statistical significance of 4.71 σ . The branching fraction of Λ c + → Λ K * + is calculated under three possible interference scenarios, with the significance increasing to 5.03 σ when interference is taken into account. Published by the American Physical Society 2025
Ablikim, M.↗
A Combined Crossed Molecular Beam and Theoretical Investigation of the Elementary Reaction of Tricarbon (C 3 (X 1 Σ g + )) with Diacetylene (C 4 H 2 (X 1 Σ g + )): Gas Phase Formation of the Heptatriynylidyne Radical ( l -C 7 H(X 2 Π))
An elucidation of the underlying formation pathways to acyclic hydrocarbons such as polyynes (C n H 2 ), cumulenes (C n H 2 ), and linear resonantly stabilized linear radicals (l-C n H) is indispensable to understand the hydrocarbon chemistry in extreme low and high temperature environments. In this study, we exploited the crossed molecular beam technique to investigate the reaction of tricarbon C 3 (X 1 Σ g + ) with diacetylene (butadiyne; HCCCCH; X 1 Σ g + ) at a collision energy of 47 ± 1 kJ mol ⁻1 . The experimental data were merged with ab initio calculations of the singlet C 7 H 2 potential energy surface (PES) revealing that the reaction is initiated via the formation of an initial van der Waals reactant complex in the entrance channel. Subsequent rearrangements lead to various carbene-type and cyclic intermediates via ring-opening, ring-closure, and hydrogen migration processes eventually forming acyclic C 7 H 2 isomers prior to their barrierless unimolecular decomposition to the most stable linear isomer, heptatriynylidyne (C 7 H, X 2 Π) in an overall endoergic reaction (+57 kJ mol ⁻1 ). The reaction exhibits strong similarities to the tricarbon – acetylene (C 3 – C 2 H 2 ). Furthermore, the significant energy threshold suggests that the tricarbon reaction with (poly)acetylenes forming resonantly stabilized linear radicals are open in high-temperature environments such as combustion flames and circumstellar envelopes of carbon stars and planetary nebulae as their descendants; however, these reactions are closed in low-temperature environments as in cold molecular clouds and hydrocarbon-rich atmospheres of planets and their moons such as in Titan.
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
Cleavage of C-O and C-C Bonds in Lignin-Derived Compounds to Produce Aromatics Using Molybdenum-Containing MFI Zeolites
Lignin, the most abundant source of renewable arenes, is a viable feedstock for the production of aromatic compounds. However, the prevalence of resilient C-C bonded oligomeric fragments in lignin-derived streams can compromise monomer yields during reductive catalytic fractionation (RCF). To address this issue, we developed a bifunctional molybdenum-containing MFI (Mo/H-MFI) zeolite catalyst capable of cleaving both C-O and C-C bonds in lignin-derived molecules to produce aromatic monomers. Using propylguaiacol as a model compound, we demonstrated the importance of proximity between metallic molybdenum carbide sites and the Bronsted acid sites in the zeolite in achieving high carbon yields (~80%) of benzene, toluene, propylbenzene, and phenol while maintaining catalyst stability (>98% stable conversion for 20 h). A reaction network involving both C-O and C-C bond cleavage pathways was proposed based on kinetic studies using key intermediates as feeds. Finally, we successfully depolymerized partially deoxygenated lignin oil obtained from the RCF of poplar using a continuous, two-pass catalytic process. This work highlights the potential of the bifunctional Mo/H-MFI catalyst in upgrading complex lignin feedstocks and provides a methodological approach for converting lignin-derived compounds into platform aromatic chemicals.
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
Identification of a small tetraheme cytochrome c and a flavocytochrome c as two of the principal soluble cytochromes c in Shewanella oneidensis strain MR1
Two abundant, low-redox-potential cytochromes c were purified from the facultative anaerobe Shewanella oneidensis strain MR1 grown anaerobically with fumarate. The small cytochrome was completely sequenced, and the genes coding for both proteins were cloned and sequenced. The small cytochrome c contains 91 residues and four heme binding sites. It is most similar to the cytochromes c from Shewanella frigidimarina (formerly Shewanella putrefaciens) NCIMB400 and the unclassified bacterial strain H1R (64 and 55% identity, respectively). The amount of the small tetraheme cytochrome is regulated by anaerobiosis, but not by fumarate. The larger of the two low-potential cytochromes contains tetraheme and flavin domains and is regulated by anaerobiosis and by fumarate and thus most nearly corresponds to the flavocytochrome c-fumarate reductase previously characterized from S. frigidimarina to which it is 59% identical. However, the genetic context of the cytochrome genes is not the same for the two Shewanella species, and they are not located in multicistronic operons. The small cytochrome c and the cytochrome domain of the flavocytochrome c are also homologous, showing 34% identity. Structural comparison shows that the Shewanella tetraheme cytochromes are not related to the Desulfovibrio cytochromes c(3) but define a new folding motif for small multiheme cytochromes c.
Cytochrome c Group/chemistry/genetics/metabolism↗
Measurement of the mass-changing, charge-changing, and production cross sections of C 11 , B 11 , and B 10 nuclei in C 12 + p interactions at 13.5 GeV / c per nucleon
A good knowledge of nuclear fragmentation cross sections is important to interpret the fluxes of secondary cosmic rays from the Galaxy. Here we report new measurements of nuclear fragmentation with the NA61/SHINE experiment at the CERN SPS. The specific focus is on cross sections important for the production of boron in the Galaxy from the interactions of C 12 nuclei with hydrogen in the interstellar medium, including the contribution from the decay of the short-lived C 11 fragments. The data were taken with the secondary C 12 beam at beam momentum of 13.5 GeV / c per nucleon and two fixed targets, polyethylene ( CH 2 ) and graphite (C), from which we derive the cross sections of carbon on hydrogen. We present the measurement of the fragmentation cross sections of C 11 , B 11 , and B 10 as well as the mass- and charge-changing cross sections.
73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
Measurement of Ω c 0 baryon production and branching-fraction ratio BR ( Ω c 0 → Ω - e + ν e ) / BR ( Ω c 0 → Ω - π + ) in p p collisions at s = 13 TeV
The inclusive production of the charm-strange baryon $Ω^0_c$ is measured for the first time via its semileptonic decay into $Ω$ - e + ν e at midrapidity (|y| < 0.8) in proton-proton (pp) collisions at the center-of mass energy $\sqrt{s}$ = 13 TeV with the ALICE detector at the LHC. The transverse momentum (p T ) differential cross section multiplied by the branching ratio is presented in the interval 2 < p T < 12 GeV=c. The branching-fraction ratio BR($Ω^0_c$ → $Ω$ - e + ν e )/BR($Ω^0_c$→ Ω - π + ) is measured to be 1.12 ± 0.22 (stat) ± 0.27 (syst). Comparisons with other experimental measurements, as well as with theoretical calculations, are presented
72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
Measurement and significance of the equilibrium reaction C-13/+/ + /C-12/O yields C-12/+/ + /C-13/O for alteration of the C-13/C-12 ratio in interstellar molecules
Laboratory measurements using the ion-cyclotron resonance technique yield a rate constant of 2 by 10 to the -10th power cu cm/sec at 300 K for the isotope exchange C-13(+) + (C-12)O yields C-12(+) + (C-13)O. According to the usual ideas about ion-molecule reactions, this rate constant should also be appropriate at temperatures not exceeding about 100 K. Then the observed C-13/C-12 ratio obtained from radio observation of interstellar molecules may be either larger or smaller than the actual value in the interstellar medium by factors of 2 or so. If the ratio is altered from the actual interstellar value, it will not be the same in all molecules, and CO will tend to have the highest value. The chief astronomical uncertainty for the occurrence of this isotope fractionation is the abundance of 'unobservable' molecules which can react rapidly with C(+): e.g., O2, H2O, CO2, and CH4. If their abundance is greater than about one-tenth that of CO, the isotope fractionation will be inhibited.
Watson, W. D.↗
H-H, C-H, and C-C NMR spin-spin coupling constants calculated by the FP-INDO method for aromatic hydrocarbons
The FP-INDO (finite perturbation-intermediate neglect of differential overlap) method is used to calculate the H-H, C-H, and C-C coupling constants in hertz for molecules of six different benzenoid hydrocarbons: benzene, naphthalene, biphenyl, anthracene, phenanthrene, and pyrene. The calculations are based on both the actual and the average molecular geometries. It is found that only the actual molecular geometries can always yield the correct relative order of values for the H-H coupling constants. For the calculated C-C coupling constants, as for the calculated C-H coupling constants, the signs are positive (negative) for an odd (even) number of bonds connecting the two nuclei. Agreements between the calculated and experimental values of the coupling constants for all six molecules are comparable to those reported previously for other molecules.
Long, S. A. T.↗
Intensity and linewidth measurements in the 13.7-micron fundamental bands of (C-12)2H2 and (C-12)(C-13)H2 at planetary atmospheric temperatures
The absolute intensities and collision-broadened half-widths of several lines in the P-,Q-, and R-branches of the nu5-fundamental band of (C-12)2H2 have been measured at various temperatures between 147 and 295 K employing the Doppler-limited spectral resolution (about 10 exp -4/cm) of a tunable diode laser spectrometer. The absolute intensities of R(5), R(7), R(9), and R(20) in the same fundamental belonging to (C-12)(C-13)H2 have also been measured at 294 K. The temperature dependence of the collision-broadened half-width has been determined for some of the lines broadened by planetary atmospheric gases, namely, He, Ar, H2, and N2. Four self-broadened linewidths of (C-12)2H2, as well as three H2-broadened linewidths and a self-broadened half-width of (C-12)(C-13)H2, have also been retrieved from the measurements.
Varanasi, Prasad↗
(C-12)/(C-13) isotope ratio in the local interstellar medium from observations of (C-13)(O-18) in molecular clouds
The paper examines the (C-12)/(C-13) isotope ratio in the solar neighborhood on the basis of observations of the (C-12)(O-18) and (C-13)(O-18) J = 1-0 transitions in four interstellar clouds located within 500 pc. The (C-12)/(C-13) ratio in these sources ranges from 57 to 74, and its weighted average is 62 +/- 4, with thermal noise and line formation uncertainties contributing about equally to the probable error. These values indicate moderate chemical evolution in the local star neighborhood since the formation of the solar system, in good agreement with model prediction of the current carbon ratio in the local interstellar medium.
Langer, William D.↗
Photochemical C( sp )–C( sp 2 ) Bond Activation in Phosphaalkynes: A New Route to Reactive Terminal Cyaphido Complexes L n M–C≡P
The photochemical activation of the C(sp)–C(sp 2 ) bond in Pt(0)-η 2 -aryl-phosphaalkyne complexes leads selectively to coordination compounds of the type L n Pt(aryl)(C≡P). The oxidative addition reaction is a novel, clean, and atom-economic route for the synthesis of reactive terminal Pt(II)-cyaphido complexes, which can undergo [3 + 2] cycloaddition reactions with organic azides, yielding the corresponding Pt(II)-triazaphospholato complexes. The C–C bond cleavage reaction is thermodynamically uphill. Upon heating, the reverse and quantitative reductive elimination toward the Pt(0)-phosphaalkyne-π-complex is observed.
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
One-bond 13 C– 13 C spin-coupling constants in saccharides: a comparison of experimental and calculated values by density functional theory using solid-state 13 C NMR and X-ray crystallography
Methyl aldohexopyranosides were 13 C-labeled at contiguous carbons, crystallized, and studied by single-crystal X-ray crystallography and solid-state 13 C nuclear magnetic resonance (NMR) spectroscopy to examine the degree to which density functional theory (DFT) can calculate one-bond 13C–13C spin-coupling constants ( 1 J CC ) in saccharides with sufficient accuracy to permit their use in MA'AT analysis, a newly-reported hybrid DFT/NMR method that provides probability distributions of molecular torsion angles in solution (Zhang et al., J. Phys. Chem. B, 2017, 121, 3042–3058; Meredith et al., J. Chem. Inf. Model., 2022, 62, 3135–3141). Experimental 1 J CC values in crystalline samples of the doubly 13 C-labeled compounds were measured by solid-state 13 C NMR and compared to those calculated from five different DFT models: (1) 1 J CC values calculated from single structures identical to those observed in crystalline samples by X-ray crystallography (all atom refinement); (2) 1 J CC values calculated from the single structures in (1) but after Hirshfeld atom refinement (HAR); (3) 1 J CC values calculated from the single structures in (1) after DFT-optimization of hydrogen atoms only; and (4 and 5) 1 J CC values calculated in rotamers of torsion angle θ 2 (C1–C2–O2–O2H) or ω(C4–C5–C6–O6) from which either specific or generalized parameterized equations were obtained and used to calculate 1 J CC values in the specific θ 2 or ω rotamers observed in crystalline samples. Good qualitative agreement was observed between calculated 1 J CC values and those measured by solid-state 13 C NMR regardless of the DFT model, but in no cases were calculated 1 J CC values quantitative, differing (over-estimated) on average by 4–5% from experimental values. These findings, and those reported recently from solution NMR studies (Tetrault et al., J. Phys. Chem. B 2022, 126, 9506–9515), indicate that improvements in DFT calculations are needed before calculated 1 J CC values can be used directly as reliable constraints in MA'AT analyses of saccharides in solution.
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
Gas-phase preparation of azulene (C 10 H 8 ) and naphthalene (C 10 H 8 ) via the reaction of the resonantly stabilized fulvenallenyl (C 7 H 5 ˙) and propargyl (C 3 H 3 ˙) radicals
The gas-phase reaction of two resonantly stabilized radicals synthesizes the 10π Hückel aromatic azulene and naphthalene – which can be embedded into saddle-shaped carbonaceous nanostructures exhibiting positive and negative curvatures.
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
Studies of friction and wear at high temperatures /up to 815 deg c/ or very low /-250 deg c/ <etude du frottement et de l'usure a des temperatures elevees /jusqu'a 815 deg c/ ou tres bases /-250 deg c/<
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Bisson, E.↗
Unconventional Pathway in the Gas‐Phase Synthesis of 9 H ‐Fluorene (C 13 H 10 ) via the Radical–Radical Reaction of Benzyl (C 7 H 7 ) with Phenyl (C 6 H 5 )
Abstract The simplest polycyclic aromatic hydrocarbon (PAH) carrying a five‐membered ring—9 H ‐fluorene (C 13 H 10 )—is produced isomer‐specifically in the gas phase by reacting benzyl (C 7 H 7 ⋅) with phenyl (C 6 H 5 ⋅) radicals in a pyrolytic reactor coupled with single photon ionization mass spectrometry. The unconventional mechanism of reaction is supported by theoretical calculations, which first produces diphenylmethane and unexpected 1‐(6‐methylenecyclohexa‐2,4‐dienyl)benzene intermediates (C 13 H 12 ) accessed via addition of the phenyl radical to the ortho position of the benzyl radical. These findings offer convincing evidence for molecular mass growth processes defying conventional wisdom that radical‐radical reactions are initiated through recombination at their radical centers. The structure of 9 H ‐fluorene acts as a molecular building block for complex curved nanostructures like fullerenes and nanobowls providing fundamental insights into the hydrocarbon evolution in high temperature settings.
He, Chao↗