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Twenty-first Century Lattice Gauge Theory: Results from the QCD Lagrangian

Quantum chromodynamics (QCD) reduces the strong interactions, in all their variety, to an elegant nonabelian gauge theory. It clearly and elegantly explains hadrons at short distances, which has led to its universal acceptance. Since its advent, however, many of its long-distance, emergent properties have been believed to be true, without having been demonstrated to be true. This paper reviews a variety of results in this regime that have been established with lattice gauge theory, directly from the QCD Lagrangian. This body of work sheds light on the origin of hadron masses, its interplay with dynamical symmetry breaking, as well as on other intriguing features such as the phase structure of QCD. In addition, nonperturbative QCD is quantitatively important to many aspects of particle physics (especially the quark flavor sector), nuclear physics, and astrophysics. This review also surveys some of the most interesting connections to those subjects.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

On the connection between continental-scale land surface processes and the tropical climate in a coupled ocean-atmosphere-land system

The impact of global tropical climate to perturbations in land surface processes (LSP) are evaluated using perturbations given by different LSP representations of continental-scale in a global climate model that includes atmosphere-ocean interactions. One representation is a simple land scheme, which specifies climatological albedos and soil moisture availability. The other representation is the more comprehensive Simplified Simple Biosphere Model, which allows for interactive soil moisture and vegetation biophysical processes. The results demonstrate that LSP processes such as interactive soil moisture and vegetation biophysical processes have strong impacts on the seasonal mean states and seasonal cycles of global precipitation, clouds, and surface air temperature. The impact is especially significant over the tropical Pacific. To explore the mechanisms for such impact, different LSP representations are confined to selected continental-scale regions where strong interactions of climate-vegetation biophysical processes are present. We find that the largest impact is mainly from LSP perturbations over the tropical African continent. The impact is through anomalous convective heating in tropical Africa due to changes in the surface heat fluxes, which in turn affect basinwide teleconnections in the Pacific through equatorial wave dynamics. The modifications in the equatorial Pacific climate are further enhanced by strong air-sea coupling between surface wind stress and upwelling, as well as effect of ocean memory. Our results further suggest that correct representations of land surface processes, land use change and the associated changes in the deep convection over tropical Africa are crucial to reducing the uncertainty when performing future climate projections under different climate change scenarios.

Ma, Hsi-Yen↗

Computational study of hydrocarbon adsorption in metal-organic framework Ni2(dhtp)

Molecular dynamic simulations were carried out to study the sorption, structural properties, and diffusivities of n-hexane and cyclohexane adsorbed in Ni2(dhtp). The results indicated strong interactions between the alkanes and the host material. The free energy perturbation method was employed to investigate the adsorption free energies of methane, ethane, n-butane, n-hexane and cyclohexane. For linear alkanes, the free energy lowered as the length of the carbon chain increased. Also, the adsorption of n-hexane was preferred over cyclohexane, due to its ability to rearrange its structure to maximize contacts with the host. Furthermore, due to the large pore size of Ni2(dhtp), higher loadings of alkanes did not significantly affect the alkane structure, and enhanced the free energy of adsorption for subsequent alkanes being loaded. According to our studies, Ni2(dhtp) has a very promising potential for adsorption and storage of alkanes. This work was supported by the US Department of Energy Basic Energy Sciences' Chemical Sciences, Geosciences & Biosciences Division. Pacific Northwest National Laboratory is operated by Battelle for the US Department of Energy.

03 NATURAL GAS↗

SO(3) “Nuclear Physics” with ultracold Gases☆

An ab initio calculation of nuclear physics from Quantum Chromodynamics (QCD), the fundamental SU(3) gauge theory of the strong interaction, remains an outstanding challenge. Here, we discuss the emergence of key elements of nuclear physics using an SO(3) lattice gauge theory as a toy model for QCD. We show that this model is accessible to state-of-the-art quantum simulation experiments with ultracold atoms in an optical lattice. First, we demonstrate that our model shares characteristic many-body features with QCD, such as the spontaneous breakdown of chiral symmetry, its restoration at finite baryon density, as well as the existence of few-body bound states. Then we show that in the one-dimensional case, the dynamics in the gauge invariant sector can be encoded as a spin S=(3/2) Heisenberg model, i.e., as quantum magnetism, which has a natural realization with bosonic mixtures in optical lattices, and thus sheds light on the connection between non-Abelian gauge theories and quantum magnetism.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Environmental effects on noble-gas hydrides: HXeBr, HXeCCH, and HXeH in noble-gas and molecular matrices

Noble-gas hydrides HNgY (Ng is a noble-gas atom and Y is an electronegative group) are sensitive probes of local environment due to their relatively weak bonding and large dipole moments. We experimentally studied HXeBr in Ar, Kr, and N{sub 2} matrices, HXeCCH in Ne and N{sub 2} matrices, and HXeH in an N{sub 2} matrix. These are the first observations of noble-gas hydrides in an N{sub 2} matrix. An N{sub 2} matrix strongly increases the H–Xe stretching frequency of HXeBr and HXeCCH with respect to a Ne matrix, which is presumably due to a strong interaction between the HNgY dipole moment and quadrupole moments of the surrounding lattice N{sub 2} molecules. The spectral shift of HXeBr in an N{sub 2} matrix is similar to that in a CO{sub 2} matrix, which is a rather unexpected result because the quadrupole moment of CO{sub 2} is about three times as large as that of N{sub 2}. The H–Xe stretching frequencies of HXeBr and HXeCCH in noble-gas matrices show a trend of ν(Ne) < ν(Xe) < ν(Kr) < ν(Ar), which is a non-monotonous function of the dielectric constants of the noble-gas solids. The MP2(full) calculations of HXeBr and HXeCCH with the polarizable continuum model as well as the CCSD(T) calculations of the HXeBr···Ng and HXeCCH···Ng (Ng = Ne, Ar, Kr, and Xe) complexes cannot fully explain the experimental observations. It is concluded that more sophisticated computational models should be used to describe these experimental findings.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Nucleon resonance electrocouplings in the non-perturbative regime

There is an extensive search for baryon resonances using the CLAS detector in Hall B of JLab. Extracting the transition helicity amplitudes (or the {gamma}{sub v}NN* photo- and electrocouplings) sheds light on nature of the non-perturbative strong interaction. We have extended the data on differential cross sections to Q{sup 2} = 6.0 GeV{sup 2} for the {pi}N electroproduction channel. Electroproduction data were also collected on the two-charged-pion channel off protons, which provides nine independent differential {pi}{sup +}{pi}{sup -}p cross sections at Q{sup 2} up to 1.5 GeV{sup 2}. The two-pion results, moreover, are consistent with those from independent {pi}N electroproduction analyses, where the background contributions in the two-pion channel are completely different from that of the single-pion one. A phenomenological approach developed at Jefferson Lab - Moscow State University is employed for separating the resonant and non-resonant contributions to the final state. The Q{sup 2}-dependent electrocouplings were then obtained for the P{sub 11}(1440) and D{sub 13}(1520) excited baryon states. The new data will be discussed in light of these new developments in systematically exploring the affects of meson-baryon dressing on the transition helicity amplitudes as a function of Q{sup 2}.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Enhancing the CDF's B physics program with a faster data acquisition system.

The physics program of Run II at the Tevatron includes precision electroweak measurements such as the determination of the top quark and W boson masses; bottom and charm physics including the determination of the B{sub s} and D{sup 0} mixing parameters; studies of the strong interaction; and searches for the Higgs particle, supersymmetric particles, hidden space-time dimensions and quark substructure. All of these measurements benefit from a high-resolution tracking detector. Most of them rely heavily on the efficient identification of heavy flavored B hadrons by detection of displaced secondary vertices, and are enhanced by the capability to trigger on tracks not coming from the primary vertex. This is uniquely provided by CDF's finely-segmented silicon detectors surrounding the interaction region. Thus CDF experiment's physics potential critically depends on the performance of its silicon detectors. The CDF silicon detectors were designed to operate up to 2-3 fb{sup -1} of accumulated pji collisions, with an upgrade planned thereafter. However, the upgrade project was canceled in 2003 and Run II has been extended through 2011, with an expected total delivered integrated luminosity of 12 fb{sup -1} or more. Several preventive measures were taken to keep the original detector operational and maintain its performance. The most important of these are the decrease in the operating temperature of the detector, which reduces the impact of radiation exposure, and measures to minimize damage due to integrated radiation dose, thermal cycles, and wire bond resonance conditions. Despite these measures the detectors operating conditions continue to change with issues arising from radiation damage to the sensors, aging infrastructure and electronics. These, together with the basic challenges posed by the inaccessibility of the detector volume and large number (about 750 thousand) of readout channels, make the silicon detector operations the single most complex and high priority job in the CDF experiment.

43 PARTICLE ACCELERATORS↗

Synthesis of flower-like Boehmite (γ-AlOOH) via a one-step ionic liquid-assisted hydrothermal route

A simple and novel synthesis process, one-step ionic liquid-assisted hydrothermal synthesis route, has been developed in the work to synthesize Bohemithe (γ-AlOOH) with flower-like structure. The samples were characterized by X-ray Diffraction (XRD), Fourier Transform Infrared Spectroscopy (FT-IR) and Scanning Electron Microscope (SEM). Ionic liquid [Omim]{sup +}Cl{sup −}, as a template, plays an important role in the morphology and pore structure of the products due to its strong interactions with reaction particles. With the increase in the dosage of ionic liquid [Omim]{sup +}Cl{sup −}, the morphology of the γ-AlOOH was changed from initial bundles of nanosheets (without ionic liquid) into final well-developed monodispersed 3D flower-like architectures ([Omim]{sup +}Cl{sup −}=72 mmol). The pore structure was also altered gradually from initial disordered slit-like pore into final relatively ordered ink-bottle pore. Furthermore, the proposed formation mechanism and other influencing factors such as reaction temperature and urea on formation and morphology of the γ-AlOOH have also been investigated. - Graphical abstract: The flower-like γ-AlOOH architectures composed by nanosheets with narrow size distribution (1.6–2.2 μm) and uniform pore size (6.92 nm) have been synthesized via a one-step ionic liquid-assisted hydrothermal route. - Highlights: • The γ-AlOOH microflowers were synthesized via an ionic liquid-assisted hydrothermal route. • Ionic liquid plays an important role on the morphology and porous structure of the products. • Ionic liquid can be easily removed from the products and reused in recycling experiments. • A “aggregation–recrystallization–Ostwald Ripening“formation mechanism may occur.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Large-momentum effective theory

Since the parton model was introduced by Feynman more than 50 years ago, much has been learned about the partonic structure of the proton through a large body of high-energy experimental data and dedicated global fits. However, limited progress has been made in calculating partonic observables such as the parton distribution function (PDFs) from the fundamental theory of strong interactions, quantum chromodynamics (QCD). Recently some advocated for a formalism, large-momentum effective theory (LaMET), through which one can extract parton physics from the properties of the proton traveling at a moderate boost factor such as γ ~ 2 – 5 . The key observation behind this approach is that Lorentz symmetry allows the standard formalism of partons in terms of light-front operators to be replaced by an equivalent one with large-momentum states and time-independent operators of a universality class. With LaMET, the PDFs, generalized PDFs or generalized parton distributions, transverse-momentum-dependent PDFs, and light-front wave functions can all be extracted in principle from lattice simulations of QCD (or other nonperturbative methods) through standard effective field theory matching and running. Future lattice QCD calculations with exascale computational facilities could help one to understand the experimental data related to the hadronic structure, including those from the upcoming electron-ion colliders dedicated to exploring the partonic landscape of the proton. In this work, the progress made in the past few years in the development of the LaMET formalism and its applications is reviewed, with an emphasis on a demonstration of its effectiveness from initial lattice QCD simulations.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

The Capabilities of the upgraded MIPP experiment with respect to Hypernuclear physics

We describe the state of analysis of the MIPP experiment, its plans to upgrade the experiment and the impact such an upgraded experiment will have on hypernuclear physics. The upgraded MIPP experiment is designed to measure the properties of strong interaction spectra form beams {pi}{sup {+-}}, K{sup {+-}}, and p{sup {+-}}, for momenta ranging from 1 GeV/c to 120 GeV/c. The layout of the apparatus in the data taken so far can be seen in Figure 1. The centerpiece of the experiment is the time projection chamber, which is followed by the time of flight counter, a multi-cell Cerenkov detector and the RICH detector. The TPC can identify charged particles with momenta less than 1 GeV/c using dE/dx, the time of flight will identify particles below approximately 2 GeV/c, the multi-cell Cerenkov detector is operational from 2.5 GeV/c to 14 GeV/c and the RICH detector can identify particles up to 120 GeVc. Following this is an EM and hadronic calorimeter capable of detecting forward going neutrons and photons. The experiment has been busy analyzing its data taken on various nuclei and beam conditions. The table 2 shows the data taken by MIPP I to date. We have almost complete acceptance in the forward hemisphere in the lab using the TPC. The reconstruction capabilities of the TPC can be seen in Figure 3. The particle identification capabilities of the TPC can be seen in Figure 4. The time of flight system provides further measurement of the particles with momenta less than 2 GeV/c. Figure 5 shows the time of flight data where a kaon peak is clearly visible.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Insights into the emergence of mass from studies of pion and kaon structure

There are two mass generating mechanisms in the standard model of particle physics (SM). One is related to the Higgs boson and fairly well understood. The other is embedded in quantum chromodynamics (QCD), the SM’s strong interaction piece; and although responsible for emergence of the roughly 1 GeV mass scale that characterises the proton and hence all observable matter, the source and impacts of this emergent hadronic mass (EHM) remain puzzling. As bound states seeded by a valence-quark and -antiquark, pseudoscalar mesons present a simpler problem in quantum field theory than that associated with the nucleon. Consequently, there is a large array of robust predictions for pion and kaon properties whose empirical validation will provide a clear window onto many effects of both mass generating mechanisms and the constructive interference between them. This has now become significant because new-era experimental facilities, in operation, construction, or planning, are capable of conducting such tests and thereby contributing greatly to resolving the puzzles of EHM. These aspects of experiment, phenomenology, and theory, along with contemporary successes and challenges, are reviewed herein. In addition to providing an overview of the experimental status, we focus on recent progress made using continuum Schwinger function methods and lattice-regularised QCD. Further, advances made using other theoretical tools are also sketched. Our primary goal is to highlight the potential gains that can accrue from a coherent effort aimed at finally reaching an understanding of the character and structure of Nature’s Nambu–Goldstone modes.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Cartan gravity, matter fields, and the gauge principle

Gravity is commonly thought of as one of the four force fields in nature. However, in standard formulations its mathematical structure is rather different from the Yang–Mills fields of particle physics that govern the electromagnetic, weak, and strong interactions. This paper explores this dissonance with particular focus on how gravity couples to matter from the perspective of the Cartan-geometric formulation of gravity. There the gravitational field is represented by a pair of variables: (1) a ‘contact vector’ V{sup A} which is geometrically visualized as the contact point between the spacetime manifold and a model spacetime being ‘rolled’ on top of it, and (2) a gauge connection A{sub μ}{sup AB}, here taken to be valued in the Lie algebra of SO(2,3) or SO(1,4), which mathematically determines how much the model spacetime is rotated when rolled. By insisting on two principles, the gauge principle and polynomial simplicity, we shall show how one can reformulate matter field actions in a way that is harmonious with Cartan’s geometric construction. This yields a formulation of all matter fields in terms of first order partial differential equations. We show in detail how the standard second order formulation can be recovered. In particular, the Hodge dual, which characterizes the structure of bosonic field equations, pops up automatically. Furthermore, the energy–momentum and spin-density three-forms are naturally combined into a single object here denoted the spin-energy–momentum three-form. Finally, we highlight a peculiarity in the mathematical structure of our first-order formulation of Yang–Mills fields. This suggests a way to unify a U(1) gauge field with gravity into a SO(1,5)-valued gauge field using a natural generalization of Cartan geometry in which the larger symmetry group is spontaneously broken down to SO(1,3)×U(1). The coupling of this unified theory to matter fields and possible extensions to non-Abelian gauge fields are left as open questions. -- Highlights: •Develops Cartan gravity to include matter fields. •Coupling to gravity is done using the standard gauge prescription. •Matter actions are manifestly polynomial in all field variables. •Standard equations recovered on-shell for scalar, spinor and Yang–Mills fields. •Unification of a U(1) field with gravity based on the orthogonal group SO(1,5)

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Lattice QCD Calculation of Nucleon Structure

It is emphasized in the 2015 NSAC Long Range Plan that "understanding the structure of hadrons in terms of QCD's quarks and gluons is one of the central goals of modern nuclear physics." Over the last three decades, lattice QCD has developed into a powerful tool for ab initio calculations of strong-interaction physics. Up until now, it is the only theoretical approach to solving QCD with controlled statistical and systematic errors. Since 1985, we have proposed and carried out first-principles calculations of nucleon structure and hadron spectroscopy using lattice QCD which entails both algorithmic development and large-scale computer simulation. We started out by calculating the nucleon form factors -- electromagnetic, axial-vector, πNN, and scalar form factors, the quark spin contribution to the proton spin, the strangeness magnetic moment, the quark orbital angular momentum, the quark momentum fraction, and the quark and glue decomposition of the proton momentum and angular momentum. The first round of calculations were done with Wilson fermions in the `quenched' approximation where the dynamical effects of the quarks in the sea are not taken into account in the Monte Carlo simulation to generate the background gauge configurations. Beginning in 2000, we have started implementing the overlap fermion formulation into the spectroscopy and structure calculations. This is mainly because the overlap fermion honors chiral symmetry as in the continuum. It is going to be more and more important to take the symmetry into account as the simulations move closer to the physical point where the u and d quark masses are as light as a few MeV only. We began with lattices which have quark masses in the sea corresponding to a pion mass at ~ 300 MeV and obtained the strange form factors, charm and strange quark masses, the charmonium spectrum and the D s meson decay constant f D s , the strangeness and charmness, the meson mass decomposition and the strange quark spin from the anomalous Ward identity. Recently, we have started to include multiple lattices with different lattice spacings and different volumes including large lattices at the physical pion mass point. We are getting quite close to being able to calculate the hadron structure at the physical point and to do the continuum and large volume extrapolations, which is our ultimate aim. We have now finished several projects which have included these systematic corrections. They include the leptonic decay width of the ρ, the πN sigma and strange sigma terms, and the strange quark magnetic moment. Over the years, we have also studied hadron spectroscopy with lattice calculations and in phenomenology. These include Roper resonance, pentaquark state, charmonium spectrum, glueballs, scalar mesons a 0 (1450) and σ(600) and other scalar mesons, and the 1 -+ meson. In addition, we have employed the canonical approach to explore the first-order phase transition and the critical point at finite density and finite temperature. We have also discovered a new parton degree of freedom -- the connected sea partons, from the path-integral formulation of the hadronic tensor, which explains the experimentally observed Gottfried sum rule violation. Combining experimental result on the strange parton distribution, the CT10 global fitting results of the total u and d anti-partons and the lattice result of the ratio of the momentum fraction of the strange vs that of u or d in the disconnected insertion, we have shown that the connected sea partons can be isolated. In this final technical report, we shall present a few representative highlights that have been achieved in the project.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Atomically Thin Polymer Layer Enhances Toughness of Graphene Oxide Monolayers

During the last decade, two-dimensional (2D)materials have emerged as versatile building blocks for the next generation of engineered materials. However, the intrinsically brittle behavior of 2D materials has thus far delayed their adoption in applications such as sensors and structural materials. Herein, we demonstrate a strategy for toughening graphene oxide (GO) through synergistic interfacial interactions between GO monolayers and ultrathin layers of strongly interacting poly(vinyl alcohol) (PVA). By creating GO-PVA and PVA-GO-PVA nanolaminates, we demonstrate a 2-fold increase in GO toughness, which translates into dramatic increases in energy dissipation and piercing resistance. Atomistic simulations show that this remarkable behavior arises from a polymer chain crack-bridging mechanism, resulting froma synergistic combination of interdomain reinforcements across the GO monolayer and extensive GO-polymer interfacial hydrogen-bonding interactions. Here, the reported findings highlight the potential for achieving engineered 2D materials with superior mechanical properties by incorporating deformation and failure-resistant mechanics arising from tailored chemical interactions between constituents.

2D materials↗

Toward Long-Range Entanglement between Electrically Driven Single-Molecule Magnets

Over the past two decades, several molecules have been explored as possible building blocks of a quantum computer, a device that would provide exponential speedups for a number of problems, including the simulation of large, strongly correlated chemical systems. Achieving strong interactions and entanglement between molecular qubits remains an outstanding challenge. In this research, we show that the TbPc 2 single-molecule magnet has the potential to overcome this obstacle because of its sensitivity to electric fields stemming from the hyperfine Stark effect. We show how this feature can be leveraged to achieve long-range entanglement between pairs of molecules using a superconducting resonator as a mediator. Our findings suggest that the molecule–resonator interaction is near the edge of the strong-coupling regime and could potentially pass into it given a more detailed, quantitative understanding of the TbPc 2 molecule.

superconducting resonator↗

Interacting dark sector and precision cosmology

We consider a recently proposed model in which dark matter interacts with a thermal background of dark radiation. Dark radiation consists of relativistic degrees of freedom which allow larger values of the expansion rate of the universe today to be consistent with CMB data (H 0 -problem). Scattering between dark matter and radiation suppresses the matter power spectrum at small scales and can explain the apparent discrepancies between ΛCDM predictions of the matter power spectrum and direct measurements of Large Scale Structure LSS (σ 8 -problem). We go beyond previous work in two ways: 1. we enlarge the parameter space of our previous model and allow for an arbitrary fraction of the dark matter to be interacting and 2. we update the data sets used in our fits, most importantly we include LSS data with full k-dependence to explore the sensitivity of current data to the shape of the matter power spectrum. We find that LSS data prefer models with overall suppressed matter clustering due to dark matter - dark radiation interactions over ΛCDM at 3-4 σ. However recent weak lensing measurements of the power spectrum are not yet precise enough to clearly distinguish two limits of the model with different predicted shapes for the linear matter power spectrum. In two Appendices we give a derivation of the coupled dark matter and dark radiation perturbation equations from the Boltzmann equation in order to clarify a confusion in the recent literature, and we derive analytic approximations to the solutions of the perturbation equations in the two physically interesting limits of all dark matter weakly interacting or a small fraction of dark matter strongly interacting.

79 ASTRONOMY AND ASTROPHYSICS↗

RECENT STAR FORMATION IN THE LEADING ARM OF THE MAGELLANIC STREAM

Strongly interacting galaxies undergo a short-lived but dramatic phase of evolution characterized by enhanced star formation, tidal tails, bridges, and other morphological peculiarities. The nearest example of a pair of interacting galaxies is the Magellanic Clouds, whose dynamical interaction produced the gaseous features known as the Magellanic Stream trailing the pair's orbit about the Galaxy, the bridge between the Clouds, and the leading arm (LA), a wide and irregular feature leading the orbit. Young, newly formed stars in the bridge are known to exist, giving witness to the recent interaction between the Clouds. However, the interaction of the Clouds with the Milky Way (MW) is less well understood. In particular, the LA must have a tidal origin; however, no purely gravitational model is able to reproduce its morphology and kinematics. A hydrodynamical interaction with the gaseous hot halo and disk of the Galaxy is plausible as suggested by some models and supporting neutral hydrogen (H I) observations. Here we show for the first time that young, recently formed stars exist in the LA, indicating that the interaction between the Clouds and our Galaxy is strong enough to trigger star formation in certain regions of the LA—regions in the outskirts of the MW disk (R ∼ 18 kpc), far away from the Clouds and the bridge.

79 ASTRONOMY AND ASTROPHYSICS↗