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HEP Software Foundation Community White Paper Working Group – Conditions Data

To produce the best physics results, high energy physics experiments require access to calibration and other non-event data during event data processing. These conditions data are typically stored in databases that provide versioning functionality, allowing physicists to make improvements while simultaneously guaranteeing the reproducibility of their results. With the increased complexity of modern experiments, and the evolution of computing models that demand large scale access to conditions data, the solutions for managing this access have evolved over time. In this white paper we give an overview of the conditions data access problem, present convergence on a common solution and present some considerations for the future.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Stochastic Molecular Dynamics

I can not pass up the opportunity to honor Graeme Bird, a true gentleman and a real scholar, if there ever was one. When we first met at a rarefied gas dynamics conference, it was instant mutual admiration. Furthermore, we met rarely thereafter at subsequent rarefied gas meetings since I attended them infrequently as a physicist interested in hydrodynamics, where often even a rarefied gas without deterministic collisions can serve as a simple fluid model but Graeme attended them regularly. In that rst meeting I became aware of DSMC, read Graeme paper and found to my astonishment that the only reference in that paper was to my molecular dynamics work2. Indeed DSMC is computationally faster competitor to molecular dynamics and it is this feature that I would like to emphasize in this brief note. It is for this reason that I entitled this contribution \stochastic molecular dynamics". I once told Graeme that that would have been a more descriptive name to his method than DSMC. DSMC is also a good demonstration that an algorithm developed for an entirely different purposes can also be very useful for other applications.

74 ATOMIC AND MOLECULAR PHYSICS↗

EFRC 10@10: Unlocking the Secrets of Plant Skeletons

In humans and other mammals, it is our bones that give form to our bodies and enable our muscles to exert force. Insects have a hard exoskeleton for the same reason. But plants—from flowers to trees—are different. Their structure comes from bundles of cellulose biomolecules that form microfibers, which combined with other materials including lignin make up the walls of plant cells. These walls are so strong that they essentially act as a skeleton. Indeed, cellulose-rich cell walls enable a slender stalk of corn to grow 6 or 8 feet tall and a giant Sequoia to tower more than 300 feet, dwarfing any other life form. Cellulose is the most abundant (and arguably the most important) long-chain biomolecule on earth. Until recently, however, cellulose—both its structure and how plants make it—was a mystery. That’s why the U.S. Department of Energy’s Office of Science funded an Energy Frontier Research Center (EFRC) to explore the topic and its implications for advanced plant-based materials and biofuels. The Center for Lignocellulose Structure and Formation included a dozen principal investigators spread across a number of universities, including physicists and engineers as well as plant biologists.

09 BIOMASS FUELS↗

2018 Fermilab Physics Slam: Explaining neutrino oscillations

For his 2018 Physics Slam presentation at Fermilab, Northwestern University scientist André de Gouvêa took on one of the most fascinating particles in physics: the neutrino. In 10 minutes, he explained—with the help of a few props—what neutrinos are and how physicists discovered that these particles can transform into one other, a phenomenon known as neutrino oscillation. At the end of the evening, the audience declared him to be the winner of the 2018 Physics Slam. Curious about neutrinos? Learn more about these particles at All Things Neutrino: http://neutrinos.fnal.gov

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Conductor Wrapping Machine

These superconducting cables will help power the Mu2e experiment when it comes online at Fermilab. Mu2e will search for a previously undiscovered process: a muon (mu) converting solely into an electron (e). Observing muon-to-electron conversion will remove a hurdle to understanding why particles in the same category, or family, decay from heavier to lighter, more stable mass states. Physicists have searched for this since the 1940s - and discovering it is central to understanding what physics lies beyond the Standard Model. To learn more about Mu2e, visit https://mu2e.fnal.gov/ and https://www.fnal.gov

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Women in Science: Fermilab Scientific Computing Specialist Krista Majewski

With February 11 marking the International Day of Women and Girls in Science, female physicists, engineers and computer scientists from CERN and Fermilab share their experiences of building careers in science. Krista Majewski came to Fermilab nine years ago as a software developer and now works in an operations role. She is a computing services specialist and part of the grid and cloud operations group, which manages computing clusters for the CMS experiment and other intensity frontier experiments at the lab. "My typical day would be maintaining the services that our group is responsible for and the machines that they run on. So if there are problems with a computing cluster where a user can't run their jobs, or they're trying to run on resources on the grid and they're unable to, then our group would be responsible for helping debug some of those issues," Krista says. Her path to programming at Fermilab has been winding. After receiving a degree in biomedical engineering, she went to work doing web development and programming for a large consulting firm, then moved to the financial industry. But programming called her back, and she earned a master's degree in computer science to start her new career. For Krista, programming is similar to something she enjoyed as child: solving puzzles. "I think it's a skill that you use in a lot of different ways," she says. Credits: Video production - Fermilab Creative Services Music Copyright: Universal Production Music Astral Light Chevalier Idea originally conceived by Tanya Levshina, Fermilab and Maria Dimou, CERN.

99 GENERAL AND MISCELLANEOUS↗

Women in Science: Fermilab cybersecurity analyst Jeny Teheran

With 11 February marking the International Day of Women and Girls in Science, female physicists, engineers and computer scientists from CERN and from Fermilab share their experiences of building a career in science. Jeny Teheran is a security analyst and cybersecurity researcher at Fermi National Accelerator Laboratory. That means keeping up with and taking care of hardware and software vulnerabilities so that the experiments can carry out their science in a secure manner. It's a fast-paced job where you have to come with the best solution you can put in place, right in the moment. "I would recommend this job because it challenges you. It pushes you to be on top of your game. You have to improve your analytical skills; you have to react fast; you have to communicate better." - Jeny says. Jeny came to Fermilab from the Caribbean coast of Colombia. She grew up in a house with few toys but lots of books, and says she has always felt close to science. With a degree in systems and computing engineering, she arrived at Fermilab four years ago as an intern to work on the offline production team for neutrino experiments. A year later, she was hired as a security analyst. "And I'm loving it," she says. Credits: Video production - Fermilab Creative Services Music Copyright: Universal Production Music Astral Light Chevalier Idea originally conceived by Tanya Levshina, Fermilab and Maria Dimou, CERN.

99 GENERAL AND MISCELLANEOUS↗

The Scikit HEP Project -- overview and prospects

Scikit-HEP is a community-driven and community-oriented project with the goal of providing an ecosystem for particle physics data analysis in Python. Scikit-HEP is a toolset of approximately twenty packages and a few "affiliated" packages. It expands the typical Python data analysis tools for particle physicists. Each package focuses on a particular topic, and interacts with other packages in the toolset, where appropriate. Most of the packages are easy to install in many environments; much work has been done this year to provide binary "wheels" on PyPI and conda-forge packages. The Scikit-HEP project has been gaining interest and momentum, by building a user and developer community engaging collaboration across experiments. Some of the packages are being used by other communities, including the astroparticle physics community. An overview of the overall project and toolset will be presented, as well as a vision for development and sustainability.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

World's Finest Gold Specimen Probed With Los Alamos Neutrons

Using neutron characterization techniques a team of scientists have peered inside one of the most unique examples of wire gold, understanding for the first time the specimen's structure and possible formation process. The 263 gram, 12 centimeter tall specimen, known as the Ram's Horn, belongs to the collection of the Mineralogical and Geological Museum Harvard University (MGMH). "Almost nothing other than the existence of the specimen is known about wire gold," said Sven Vogel, a physicist at Los Alamos National Laboratory's neutron science center, LANSCE, a half-mile-long particle accelerator that provides high- and low-energy protons and neutrons for a wide variety of scientific research. Found in 1887 at the Ground Hog Mine in Red Cliff, Colorado, mysteriously shaped like a twisted bunch of wires instead of the more recognizable golden nugget, the Ram's Horn has baffled mineralogists since its discovery. The unknown: what is its fundamental structure and how did it form? "Some native metals, a metal or metal alloy found in nature can occur in what is called wire morphology," said John Rakovan, Professor of Mineralogy at Miami University in Ohio. "Much more common in silver, the wire morphology is rarely seen in gold samples and this specimen is without question the finest known example."

58 GEOSCIENCES↗

Simulation and Development of the Radial Time Projection Chamber For the Bonus12 Experiment in CLAS12

Knowledge of the structure of nucleons (i.e. protons and neutrons) is a central topic of interest to nuclear/particle physicists. Much more is known about the structure of the proton than the neutron due to the lack of high-density free neutron targets. The Barely Off-shell Nucleon Structure experiment (BONuS12) at Jefferson Lab (JLab) is a second generation experiment upgraded/optimized to advance our knowledge of the neutron's structure using the deep-inelastic scattering of electrons off deuterium. Typically, since deuterium is a nuclear target, corrections for off-shell and nuclear binding effects must be taken into account in order to extract results on the neutron. These corrections are model-dependent and therefore have limited our success in extracting neutron information using deuterium targets. In the BONuS12 experiment, 10.6 GeV electrons are scattered off of a deuterium target. By detecting the low momentum spectator proton at backward angles, the uncertainty due to final state interactions is minimized. The goal of the experiment is to measure the ratio of the neutron to proton structure functions ($F^n_2/F^p_2$) as the Bjroken scaling variable x approaches 1. The newly designed Radial Time Projection Chamber (RTPC) for BONuS12 detects the spectator proton in coincidence with the scattered electron, which is detected in the CEBAF Large Acceptance Spectrometer (CLAS12). This work presents the simulation and development of the new BONuS12 RTPC. The design, construction, and testing of the Drift-gas Monitoring Sysytem (DMS) for the BONuS12 experiment is also described. The results of the DMS operation as well as the first preliminary data from the BONuS12 experimental run are given. Because the BONuS12 data analysis depends on CLAS12 working effectively, an effort to verify the CLAS12 operation with the extraction of the inclusive deep inelastic cross section from the first experiment in CLAS12 (Run Group A) will be presented.

Dzbenski, Nathan↗

Parameter Determination of the Non-Local Granular Fluidity Model for Wood Chips by Comparison to Well-Defined Experimental Flow Systems

Unlike simple liquids and gases, the bulk flow and transport of granular materials remain poorly understood by physicists and pose many problems for engineers in designing and operating bulk-solids handling equipment. Discrete element methods (DEM) are currently considered the state-of-the-art for simulating the flow of granular materials, but DEM is limited in system size to about a few million particles due to high computational costs, even when run on current high-performance computing architectures. Continuum models are needed to simulate the flows of bulk solids in industrial-scale vessels and equipment, e.g., grain silos and coal-ash disposal piles. The focus of this work is the so-called nonlocal granular fluidity (NLGF) model that has been previously shown to reproduce observed nonlocal behaviors that arise when granular phenomena occur on length scales that are near the scale of the system geometry, e.g., the jamming of hopper outlets and the stop-height of piles on inclines [PNAS, 110(17), 6730-6735]. We have implemented the NLGF constitutive model in OpenFOAM CFD software, performed simulations of well-defined flow systems, and compared the results to experimental data. Experimental systems include a ring-shear tester, pile formation, flow on an incline, and discharge of a hopper. The tested material was loblolly pine wood chips that were milled and sieved to a size range of roughly 0.05-0.25 inches in diameter. The NLGF model parameters were tuned to achieve reasonable agreement between simulation and experimental results. Further, we evaluate the mapping between measurable material properties (bulk friction angle, particle-particle friction, compressibility, grain diameter, etc.) with NLGF model parameters, some of which have direct analogs (friction parameters and grain diameter) while others are constructs of the model (nonlocal amplitude and timescale of fluidity evolution).

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

Alvin Tollestrup (1924-2020): A Life in Science

Alvin Tollestrup was a physicist and engineer of uncommon insight, intuition, and ingenuity who was revered in life for his essential leadership in the development of superconducting magnets for high-energy accelerators. He exhibited a matchless mastery of what he called freshman physics — though his mastery hardly ended there — and an uncanny gift for joining careful measurements with transparent calculations to reveal the essence of a subject. To watch Alvin at work was to learn how a true scientist formulates and solves a problem. He had other gifts: a nose for significant problems in both science and technology, the ability to draw talented people to an important cause, and a mentor's instinct for spotting gifted junior colleagues and helping them to mature as engineers and scientists. He was also good company! Alvin brought his keen vision about what constitutes important science, along with powerful ambition for the institution and for fundamental science, to considerat ions about Fermilab's future. His questions were uniformly probing, his opinions unfailingly interesting, and his appetite for work consistently inspiring. Among Alvin's many contributions to experimental particle physics — in a career that spanned seven decades — the rich achievements of the Collider Detector at Fermilab Collaboration, of which he was a founder and an enduring leader, stand out. The discovery of the top quark in 1995 earned worldwide acclaim. He reaped individual accolades as well, including election to the National Academy of Sciences. The National Medal of Technology, conferred in 1989, recognized Alvin’s leading role in developing superconducting magnets for Fermilab's Tevatron. Universities Research Association created the Tollestrup Award for Postdoctoral Research, commemorating Alvin's avuncular support for young scientists. This volume celebrates Alvin Tollestrup’s career and the rich, fulfilling life he led beyond the laboratory. Contributions from colleagues and family illuminate many facets of this remarka! ble figure. May old friends savor the memory of the Alvin they knew, while discovering less-familiar parts of his history; and may readers who did not have the opportunity to know Alvin firsthand find inspiration in his exemplary life in science.

Palmer, Mark↗

Status of the Fermilab Muon g - 2 Experiment

The muon anomalous magnetic moment, aµ = ( g - 2 )/2, is a low-energy observable which can be both measured and computed with very high precision, making it an excellent test of the Standard Model (SM) and a sensitive probe of new physics. Recent efforts improved the precision of both the theoretical prediction and the experimental measurement. On the theory side, the Muon g - 2 Theory Initiative, an international team of more than 130 physicists, reached in 2020 a consensus on the SM prediction for aµ. On the experimental side, the E989 Muon g - 2 Collaboration at Fermilab (FNAL) published in April 2021 a new measurement of aµ from the Run-1 dataset (2018) with 0.46 ppm precision, corroborating the previous Brookhaven National Laboratory (BNL) measurement and increasing the discrepancy with the SM value to 4.2 standard deviations. In this paper, I will discuss the experimental setup and report on the current status of the experiment.

Girotti, Paolo↗

Enabling U.S. participation in Future Higgs Factories

Exciting proposals for a new Higgs factory collider, aimed at the search for new physics and precision studies of particles and forces, especially measurement of the Higgs boson couplings at the loop level, will be evaluated as part of the Snowmass process. Potential facilities include (among others) ILC, FCC-ee, C3, CEPC, CLIC, muon collider and advanced accelerator concepts being investigated by Snowmass topical group AF6, potentially located in Asia, Europe, or the United States. The European Strategy has endorsed an electron-positron Higgs factory as its highest priority after HL-LHC. Much of the detector, software, and physics preparative studies needed for these machines is in common, and is currently being implemented by physicists world-wide. In this white paper for the 2021 Snowmass process we look at current global activity on future Higgs factories and give examples of investments that could be made in these common areas over the next five years to establish a leadership role for the U.S. in a future Higgs factory, wherever it is built. The U.S. high energy physics program confronts a number of challenges that a strong role in the study of the Higgs boson can address. These include, in addition to the scientific results, maintaining leading roles in international partnerships, nurturing and advancing world-leading capabilities and expert resources, and maintaining and attracting talent. The international effort would benefit from increased U.S. participation, and the U.S., in turn, would maintain stature through the partnership.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Informal Socialization in Physics Training

This paper addresses issues related to the process of informal socialization into physics, particularly for senior graduate students and postdoctoral scholars. Many physicists' careers are built on the relationships they have and develop during these critical years.

Hodari, Apriel K.↗

Forward Physics Facility

High-energy collisions at the High-Luminosity Large Hadron Collider will produce a large number of particles along the beam collision axis, outside of the acceptance of existing LHC experiments. The proposed Forward Physics Facility (FPF), to be located 617--682 meters from the ATLAS interaction point along the beam collision axis and shielded by concrete and rock, will host a suite of experiments to probe Standard Model processes and search for physics beyond the Standard Model. The FPF is supported by a rapidly growing user community of 400 physicists, and four pathfinder detectors that are currently operating at the LHC have already yielded promising results, including the first direct detection of collider neutrinos. Here we provide an Executive Summary, and then briefly summarize the status of the FPF, including its rich science case, the facility itself, the proposed FPF experiments and their technical readiness, the preliminary schedule and budget profile, and plans for international participation. Submitted to the DOE/NSF HEPAP Particle Physics Projects Prioritization Panel~(P5)

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

The Role of the CEBAF Element Database in Commissioning the 12GeV Accelerator Upgrade

The CEBAF Element Database (CED) was first developed in 2010 as a resource to support model-driven configuration of the Jefferson Lab Continuous Electron Beam Accelerator (CEBAF). Since that time, its uniquely flexible schema design, robust programming interface, and support for multiple concurrent versions has permitted it to evolve into a more broadly useful operational and control system tool. The CED played a critical role before and during the 2013 startup and commissioning of CEBAF following its 18-month long shutdown and upgrade. Information in the CED about hardware components and their relations to one-another facilitated a thorough Hot Checkout process involving more than 18,000 system checks. New software relies on the CED to generate EDM screens for operators on-demand thereby ensuring that the information on those screens is correct and up-to-date. The CED also continues to fulfill its original mission of supporting model-driven accelerator setup. Using the new ced2elegant and eDT (elegant Download Tool), accelerator physicists have proven able to compute and apply energy-dependant set points with greater efficiency than ever before.

Larrieu, T.↗

Estimation of multi-group cross section covariances for {sup 235,238}U, {sup 239}Pu, {sup 241}Am, {sup 56}Fe, {sup 23}Na and {sup 27}Al

This paper presents the methodology used to estimate multi-group covariances for some major isotopes used in reactor physics. The starting point of this evaluation is the modelling of the neutron induced reactions based on nuclear reaction models with parameters. These latest are the vectors of uncertainties as they are absorbing uncertainties and correlation arising from the confrontation of nuclear reaction model to microscopic experiment. These uncertainties are then propagated towards multi-group cross sections. As major breakthroughs were then asked by nuclear reactor physicists to assess proper uncertainties to be used in applications, a solution is proposed by the use of integral experiment information at two different stages in the covariance estimation. In this paper, we will explain briefly the treatment of all type of uncertainties, including experimental ones (statistical and systematic) as well as those coming from validation of nuclear data on dedicated integral experiment (nuclear data oriented). We will illustrate the use of this methodology with various isotopes such as {sup 235,238}U, {sup 239}Pu, {sup 241}Am, {sup 56}Fe, {sup 23}Na and {sup 27}Al. (authors)

22 GENERAL STUDIES OF NUCLEAR REACTORS↗