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  1. We investigated the role of multireference correlation effects in oligophenyl chains to clarify their importance compared to electrode design and coupling as well as geometric effects in causing conductance decay reversals.

     
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    Free, publicly-accessible full text available February 22, 2025
  2. Colloids that attractively bond to only a few neighbors (e.g., patchy particles) can form equilibrium gels with distinctive dynamic properties that are stable in time. Here, we use a coarse-grained model to explore the dynamics of linked networks of patchy colloids whose average valence is macroscopically, rather than microscopically, constrained. Simulation results for the model show dynamic hallmarks of equilibrium gel formation and establish that the colloid–colloid bond persistence time controls the characteristic slow relaxation of the self-intermediate scattering function. The model features re-entrant network formation without phase separation as a function of linker concentration, centered at the stoichiometric ratio of linker ends to nanoparticle surface bonding sites. Departures from stoichiometry result in linker-starved or linker-saturated networks with reduced connectivity and shorter characteristic relaxation times with lower activation energies. Underlying the re-entrant trends, dynamic properties vary monotonically with the number of effective network bonds per colloid, a quantity that can be predicted using Wertheim’s thermodynamic perturbation theory. These behaviors suggest macroscopic in situ strategies for tuning the dynamic response of colloidal networks. 
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  3. In this thesis, I present a decentralized sparse Gaussian process regression (DSGPR) model with event-triggered, adaptive inducing points. This DSGPR model brings the advantages of sparse Gaussian process regression to a decentralized implementation. Being decentralized and sparse provides advantages that are ideal for multi-agent systems (MASs) performing environmental modeling. In this case, MASs need to model large amounts of information while having potential intermittent communication connections. Additionally, the model needs to correctly perform uncertainty propagation between autonomous agents and ensure high accuracy on the prediction. For the model to meet these requirements, a bounded and efficient real-time sparse Gaussian process regression (SGPR) model is needed. I improve real-time SGPR models in these regards by introducing an adaptation of the mean shift and fixed-width clustering algorithms called radial clustering. Radial clustering enables real-time SGPR models to have an adaptive number of inducing points through an efficient inducing point selection process. I show how this clustering approach scales better than other seminal Gaussian process regression (GPR) and SGPR models for real-time purposes while attaining similar prediction accuracy and uncertainty reduction performance. Furthermore, this thesis addresses common issues inherent in decentralized frameworks such as high computation costs, inter-agent message bandwidth restrictions, and data fusion integrity. These challenges are addressed in part through performing maximum consensus between local agent models which enables the MAS to gain the advantages of decentralization while keeping data fusion integrity. The inter-agent communication restrictions are addressed through the contribution of two message passing heuristics called the covariance reduction heuristic and the Bhattacharyya distance heuristic. These heuristics enable user to reduce message passing frequency and message size through the Bhattacharyya distance and properties of spatial kernels. The entire DSGPR framework is evaluated on multiple simulated random vector fields. The results show that this framework effectively estimates vector fields using multiple autonomous agents. This vector field is assumed to be a wind field; however, this framework may be applied to the estimation of other scalar or vector fields (e.g., fluids, magnetic fields, electricity, etc.). Keywords: Sparse Gaussian process regression, clustering, event-triggered, decentralized, sensor fusion, uncertainty propagation, inducing points 
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  4. Free, publicly-accessible full text available September 1, 2024
  5. Free, publicly-accessible full text available August 1, 2024
  6. Free, publicly-accessible full text available July 1, 2024
  7. A bstract We report on a measurement of the $$ {\Lambda}_c^{+} $$ Λ c + to D 0 production ratio in peripheral PbPb collisions at $$ \sqrt{s_{\textrm{NN}}} $$ s NN = 5 . 02 TeV with the LHCb detector in the forward rapidity region 2 < y < 4 . 5. The $$ {\Lambda}_c^{+} $$ Λ c + ( D 0 ) hadrons are reconstructed via the decay channel $$ {\Lambda}_c^{+} $$ Λ c + → pK − π + ( D 0 → K − π + ) for 2 < p T < 8 GeV/ c and in the centrality range of about 65–90%. The results show no significant dependence on p T , y or the mean number of participating nucleons. They are also consistent with similar measurements obtained by the LHCb collaboration in pPb and Pbp collisions at $$ \sqrt{s_{\textrm{NN}}} $$ s NN = 5 . 02 TeV. The data agree well with predictions from PYTHIA in pp collisions at $$ \sqrt{s} $$ s = 5 TeV but are in tension with predictions of the Statistical Hadronization model. 
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    Free, publicly-accessible full text available June 1, 2024
  8. A bstract A search for the lepton-flavour violating decays B 0 → K *0 μ ± e ∓ and $$ {B}_s^0 $$ B s 0 → ϕμ ± e ∓ is presented, using proton-proton collision data collected by the LHCb detector at the LHC, corresponding to an integrated luminosity of 9 fb − 1 . No significant signals are observed and upper limits of $$ {\displaystyle \begin{array}{c}\mathcal{B}\left({B}^0\to {K}^{\ast 0}{\mu}^{+}{e}^{-}\right)<5.7\times {10}^{-9}\left(6.9\times {10}^{-9}\right),\\ {}\mathcal{B}\left({B}^0\to {K}^{\ast 0}{\mu}^{-}{e}^{+}\right)<6.8\times {10}^{-9}\left(7.9\times {10}^{-9}\right),\\ {}\mathcal{B}\left({B}^0\to {K}^{\ast 0}{\mu}^{\pm }{e}^{\mp}\right)<10.1\times {10}^{-9}\left(11.7\times {10}^{-9}\right),\\ {}\mathcal{B}\left({B}_s^0\to \phi {\mu}^{\pm }{e}^{\mp}\right)<16.0\times {10}^{-9}\left(19.8\times {10}^{-9}\right)\end{array}} $$ B B 0 → K ∗ 0 μ + e − < 5.7 × 10 − 9 6.9 × 10 − 9 , B B 0 → K ∗ 0 μ − e + < 6.8 × 10 − 9 7.9 × 10 − 9 , B B 0 → K ∗ 0 μ ± e ∓ < 10.1 × 10 − 9 11.7 × 10 − 9 , B B s 0 → ϕ μ ± e ∓ < 16.0 × 10 − 9 19.8 × 10 − 9 are set at 90% (95%) confidence level. These results constitute the world’s most stringent limits to date, with the limit on the decay $$ {B}_s^0 $$ B s 0 → ϕμ ± e ∓ the first being set. In addition, limits are reported for scalar and left-handed lepton-flavour violating New Physics scenarios. 
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    Free, publicly-accessible full text available June 1, 2024
  9. A bstract A first search for the lepton-flavour violating decays B 0 → K *0 τ ± μ ∓ is presented. The analysis is performed using a sample of proton-proton collision data, collected with the LHCb detector at centre-of-mass energies of 7, 8 and 13 TeV between 2011 and 2018, corresponding to an integrated luminosity of 9 fb − 1 . No significant signal is observed, and upper limits on the branching fractions are determined to be $$ \mathcal{B}\left({B}^0\to {K}^{\ast 0}{\tau}^{+}{\mu}^{-}\right)<1.0(1.2)\times {10}^{-5} $$ B B 0 → K ∗ 0 τ + μ − < 1.0 1.2 × 10 − 5 and $$ \mathcal{B}\left({B}^0\to {K}^{\ast 0}{\tau}^{-}{\mu}^{+}\right)<8.2(9.8)\times {10}^{-6} $$ B B 0 → K ∗ 0 τ − μ + < 8.2 9.8 × 10 − 6 at the 90% (95%) confidence level. 
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    Free, publicly-accessible full text available June 1, 2024