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At least 541 records · Page 30

Beyond Optimization: Exploring Novelty Discovery in Autonomous Experiments

Autonomous experiments (AEs) are transforming how scientific research is conducted by integrating artificial intelligence with automated experimental platforms. Current AEs primarily focus on the optimization of a predefined target; while accelerating this goal, such an approach limits the discovery of unexpected or unknown physical phenomena. Here, we introduce a novel framework, INS 2 ANE (Integrated Novelty Score−Strategic Autonomous Non-Smooth Exploration), to enhance the discovery of novel phenomena in autonomous microscopy experimentation. Our method integrates two key components: (1) a novelty scoring system that evaluates the uniqueness of experimental results and (2) a strategic sampling mechanism that promotes exploration of under-sampled regions even if they appear less promising by conventional criteria. We validate this approach on a preacquired data set with a known ground truth comprising of image−spectral pairs. We further implement the process on autonomous scanning probe microscopy experiments. INS 2 ANE significantly increases the diversity of explored phenomena in comparison to conventional optimization routines, enhancing the likelihood of discovering previously unobserved phenomena. These results demonstrate the potential for autonomous microscopy experiments to enhance the scientific discovery by navigating complex experimental spaces to uncover novel phenomena.

Materials↗

NASA GIBS and Worldview: Leveraging Visualizations to Improve Data Discovery

NASA's Global Imagery Browse Services (GIBS) leverages scientific and community best practices and standards to provide a scalable, compliant, and authoritative source for NASA Earth Observing System (EOS) Earth science data visualizations. Since 2013, its goal has been to "transform how end users interact and discover [EOS] data through visualizations." Imagery layers within GIBS allow end users to easily and quickly interact with full resolution, pre-generated visualizations of scientific parameters. This interactive discovery approach relies on visual observation and identification of phenomena that are not as simply identified otherwise.

Global Imagery Browse Services↗

The DIARieS Ecosystem – A Software Ecosystem to Simplify Discovery, Implementation, Analysis, Reproducibility, and Sharing of Scientific Results and Environments in Heliophysics

The infrastructure of the Heliophysics discipline has promising components but with several missing gaps, drastically reducing research and development efficiency. Developing an online discovery and analysis software ecosystem will close several of these gaps. The five main focuses on this ecosystem should be Discovery, Implementation, Analysis, Reproducibility, and Sharing of results (DIARieS). In this paper, we give a detailed description of how the proposed software ecosystem should operate, and point out the large range of possible applications to benefit many disparate groups, such as researchers, operational staff, decision-makers, and educators. The infrastructure components and technological capabilities necessary for its completion are either currently available or in development, making such an ecosystem possible for the first time. One main focus of current infrastructure investments must be to adapt and connect these pieces together into a cohesive whole to increase our research and development efficiency.

infrastructure↗

What makes a discovery?

In this contribution to the proceedings of the 182nd Nobel Symposium, I reflect on the concept of “discovery” as it is used by physicists and astronomers. In particular, I comment on how the scientific community distinguishes discoveries from propositions that are supported only by lesser forms of evidence, emphasizing the social nature of this process and remarking on the subjective factors that go into making such judgments. I advocate for an approach that is intentionally Bayesian in nature, in which individuals are encouraged to evaluate and publicly state their priors and to update them systematically. I close by applying these practices to the case example of the Galactic Center Gamma-Ray Excess.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Cultivating A Culture of Inclusivity in Heliophysics

The decadal survey will help guide the Heliophysics community to create opportunities for future success. A uniquely fundamental question will drive science innovations and discoveries in the coming decades: What research environment and community will we build? The most innovative scientific ideas and discoveries develop in safe, inclusive, diverse, accessible, and collaborative environments. These environments strengthen all types of collaborations and advance innovations in concepts and applications. If we ignore this critical aspect of science, current issues regarding diversity, retention, and succession will persist. This paper discusses current critical problems and introduces actionable steps that can cultivate a culture of inclusivity.

A.J. Halford↗

5G Enabled Energy Innovation: Advanced Wireless Networks for Science (Workshop Report)

Rapidly expanding, new telecommunications infrastructure based on 5G technologies will disrupt and transform how we design, build, operate, and optimize scientific infrastructure and the experiments and services enabled by that infrastructure, from continental-scale sensor networks to centralized scientific user facilities, from intelligent Internet of Things devices to supercomputers. Concurrently, 5G will introduce, or exacerbate, challenges related to protecting infrastructure and associated scientific data as well as to fully leveraging opportunities related to expanded infrastructure scale and complexity. The U.S. Department of Energy (DOE) Office of Science operates scientific infrastructure, supporting some of the nation’s most advanced intellectual discoveries, spanning the country and including 30 world-class user facilities from supercomputers to accelerators. Along with field experiments and remote observatories, every aspect of DOE’s scientific enterprise will be affected by 5G, which amounts to a complete renovation of the underpinnings of the nation’s information infrastructure. In this report we explore the scientific opportunities and new research challenges associated with 5G, ranging from scalability to heterogeneity to cybersecurity. The rapid commercial deployment of 5G opens the opportunity to rethink and reinvent DOE’s scientific infrastructure and experimentation, from intelligent sensor networks at unprecedented scales to a digital continuum of cyberinfrastructure spanning low-power sensors, high-performance computing embedded within and at the edge of the network, and DOE’s large-scale user instrument and computing facilities. New programming paradigms, workflow and data frameworks, and AI-based system design, operation, and autonomous adaptation and optimization will be necessary in order to exploit these new opportunities. Field deployments and centralized scientific instruments can also be revolutionized, moving (without traditional performance penalties) from wired to wireless connectivity for data and control systems, improving flexibility, and opening new sensing modalities, including the use of the 5G electromagnetic spectrum itself as an environmental probe. For DOE science, in contrast to commercial 5G applications and settings, devices will be deployed in extreme environments such as cryogenically cooled instrument control systems and in remote settings with harsh conditions, requiring the design of new materials for RF communication and edge processing to operate in these regimes. Concurrently, 5G infrastructure comprises both hardware and sophisticated software systems - currently closed and proprietary. The cybersecurity challenges to 5G-empowered reinvention mirror the complexity and variety of new 5G features, from virtualization to private network slices to ubiquitous access. Research is also needed in order to accelerate the development of secure and open 5G software infrastructure, reducing reliance on hardware and software produced outside the United States and providing the transparency and rigorous evaluation and testing afforded through open software. Twelve broad research thrusts are laid out in four chapters, with a companion fifth chapter (and three additional research thrusts) underscoring the needs and opportunities for an aggressive testbed program co-designed by networking experts and scientists involved in the 15 research thrusts. The urgency of undertaking this research is fueled by a global, accelerating deployment of new telecommunications infrastructure that is designed for entertainment and commercial applications - barely scratching the surface of what 5G can do to extend U.S. leadership in scientific discovery.

42 ENGINEERING↗

Leadership at Interfaces: Capitalizing on the "Gaps" in Science, Technology and Education [Slides]

Leadership in the scientific enterprise is most commonly exemplified by those who commandeer major discoveries and critical breakthroughs that expand boundaries, naturally underpinning a competitive spirit among peers in the field. However, many other leadership opportunities exist at the interfaces of such boundaries - as well as at the interfaces of scientific disciplines, classes of professions and across generations - and may enable alternative guiding philosophies that are intrinsically less prone to competition and saturation, and perhaps appreciation. This presentation features a personal reflection of scientific and leadership philosophies that were intentionally manifested at, and by, irreplaceable interfaces of human creativity. Reaction engineering, an increasingly vanishing discipline within chemical engineering, is emphasized as a manifestation of interfacial leadership and serves as a vehicle to trace pivotal career moments in both the speaker's scientific discoveries and in his relational values within human enterprises.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

A Decade of GRETINA Science

High-resolution γ-ray detector arrays have driven many scientific advances and discoveries in nuclear physics. Today, they provide a powerful and essential tool for a broad class of measurements in the study of nuclear structure and reactions, nuclear astrophysics, and applied nuclear science. In this article, we present an overview of the scientific program that has been enabled by the γ-ray tracking array GRETINA [Pas13]. This program is being carried out at both stable and radioactive ion beam facilities, employs a wide range of beam energies and reactions (from the Coulomb barrier to more than 30% the speed of light), and reflects the varied application of a γ-ray tracking array.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

The OSO-7 year of discovery.

The OSO 7 scientific findings reveal hitherto unknown processes in solar flares and some remarkable properties of the corona. Gamma-ray emission lines provide evidence of nuclear reactions in solar flares. The measurements were made during the large flares of Aug. 4 and 7, 1972. The data clearly show line emission at energies of about 0.5 MeV (million electron volts) and 2.2 MeV, with weaker enhancements at 4.4 MeV and 6.1 MeV. It appears that the nuclear processes in flares as revealed by OSO 7 are probably thermal reactions. Some flare electron streams also produce bursts of hard X rays. Holes and poles in the corona, and coronal streams and the interplanetary blast were studied.

Maran, S. P.↗

Discovery Through Biospecimen Sharing: The Nasa Biological Institutional Scientific Collection (NBISC)

NASA Ames Research Center has fostered collaborations with other NASA centers, universities, and international space agencies by sharing non-human biospecimens from spaceflight and space-relevant ground experiments since the 1960s. These collaborations have advanced the field of space exploration by helping to maximize the data gained from spaceflight experiments. Non-human tissues archived from experiments funded by NASA’s Space Biology and Human Research Programs (HRP) are available for request through the NASA Life Sciences Portal (NLSP) and distributed by the NASA Biological Institutional Scientific Collection (NBISC). NBISC coordinates closely with the Ames Biospecimen Sharing Program (BSP) which is responsible for sample collection from spaceflight and ground experiments. NBISC currently houses more than 90,000 biospecimens in its facility at NASA Ames. Until recently, NBISC primarily distributed samples from Space Biology funded research. In 2022 NBISC partnered with HRP Space Radiation Element to also archive samples from studies which primarily involve rodents exposed to galactic cosmic radiation simulations at the NASA Space Radiation Laboratory (NSRL) and other analog facilities. In this presentation we will highlight several success stories of analyses carried out using archived NBISC samples received by researchers in recent years and will detail the process for proposing and receiving samples from NBISC. Making available these 90,000+ unique biospecimens to the scientific research community, NBISC not only functions as a resource for storing and distributing non-human biospecimens, but as a warehouse for future discoveries for the benefit of NASA and humankind.

NBISC↗

Ensemble Simulations on Leadership Computing Systems

Scientific productivity can be enhanced through workflow management tools, relieving large High Performance Computing (HPC) system users from the tedious tasks of scheduling and designing the complex computational execution of scientific applications. This paper presents a study on the usage of ensemble workflow tools to accelerate science using the Summit and Frontier supercomputing systems. The research aims to connect science domain simulations using Oak Ridge Leadership Computing Facility (OLCF) supercomputing platforms with ensemble workflow methods in order to accelerate HPC-enabled discovery and boost scientific impact. We present the coupling, porting and optimization of Radical-Cybertools on three applications: Chroma, NAMD and LAMMPS. The tools augment traditional HPC monolithic runs with a pilot scheduler. Lessons-learned are discussed for physics, biology and materials science applications. We discuss intrinsic limitations of coupling and porting ensemble workflow tools to applications that run on large HPC systems. The origins of technical challenges and their solutions developed during the implementation process are discussed. Data management strategies, OLCF’s policies for ensembles, and natively supported workflow tools are also summarized.

Georgiadou, Antigoni [ORNL] (ORCID:000000020977631↗

Preface to the Special Collection: Recollections in Space Physics

Space Physics is a comparatively young scientific discipline, tightly linked to the era of satellite based investigations and the discoveries that came with it. As such, we as a community are fortunate to have met, been taught and mentored by, and even become friends with, many of those who were around to witness the birth of, and in many cases establish, our field. Each of these "Pioneers" have remarkable stories to tell. These accounts from the dawn of the space age provide a glimpse into that era of scientific discovery and are an important part of our collective history that deserve to be shared and commemorated. These are stories of perseverance, ingenuity, luck, and sometimes failure. We are fortunate to live in an era in which these distinguished scientists are still with us and able to share their experiences.To commemorate the 100th Anniversary of the American Geophysical Union (AGU), we have solicited a special collection of recollection papers to memorialize these experiences. This is not the first such effort to capture these stories. In 1994 (Vol. 99, No. A10, pp. 19,099-19,212) and again in 1996 (Vol. 101, No. A5, pp. 10,477-10,585) JGRSpace Physics published special sections entitled, "Pioneers of Space Physics," in celebration of AGU's 75th anniversary. Later, in 1997, Gilmore and Spreiter (1997) added a set of recollection papers on the discovery of the magnetosphere. Together, these papers containing personal accounts from the pioneers of the space age covered the period of roughly 1958-1967.It is our great honor to present retrospective papers from several of our distinguished colleagues who contributed significantly to the explosion in understanding of space physics and aeronomy that occurred from roughly 1967-1980. We chose to start at the end of the previous set of recollections and cover the decade of the 1970s, during which our field greatly expanded. It is also a time in which the second generation of space scientists entered the field and made foundational discoveries that continue to define our discipline.As with the previous papers, we asked the authors to "recount some of the events leading to the emergence of space physics and to put the events into a professional as well as personal perspective." (Gombosi et al.,1994). The authors of this special collection of recollections were selected following the same guidelines as the previous efforts. We started from a long list of senior colleagues and narrowed the list to roughly two dozen distinguished scientists based on discipline and geographic balance. Some of our colleagues, when asked, felt they would be unable to devote the time or energy to such a recollection and declined. Sadly,in the intervening 25 years since the original effort, some of our colleagues who were most active during the early years of the space age have passed. Therefore, this new special collection, 25 years after the first one, is timely with the AGU centennial celebrations, but late in fully capturing the stories of the pioneers of space physics. This is unfortunate and we encourage future editors of this journal to commission specialsections of legacy perspectives with a faster cadence than a quarter of a century.

Kepko, Emil L.↗

VISION: a modular AI assistant for natural human-instrument interaction at scientific user facilities

Scientific user facilities, such as synchrotron beamlines, are equipped with a wide array of hardware and software tools that require a codebase for human-computer-interaction. This often necessitates developers to be involved to establish connection between users/researchers and the complex instrumentation. The advent of generative AI presents an opportunity to bridge this knowledge gap, enabling seamless communication and efficient experimental workflows. Here we present a modular architecture for the Virtual Scientific Companion by assembling multiple AI-enabled cognitive blocks that each scaffolds large language models (LLMs) for a specialized task. With VISION, we performed LLM-based operation on the beamline workstation with low latency and demonstrated the first voice-controlled experiment at an x-ray scattering beamline. The modular and scalable architecture allows for easy adaptation to new instruments and capabilities. Development on natural language-based scientific experimentation is a building block for an impending future where a science exocortex—a synthetic extension to the cognition of scientists—may radically transform scientific practice and discovery.

36 MATERIALS SCIENCE↗

epicsuite(EAS)

Software, Documentation, Tutorials, Testing data, Example data for processing, analysis, filtering, querying, visualization and otherwise transforming genomic data for scientific analysis and discovery.

Rogers, David H.↗

2021 Site Environmental Report (SER) for the Ernest Orlando Lawrence Berkeley National Laboratory (LBNL)

Lawrence Berkeley National Laboratory (LBNL, Berkeley Lab) is a multiprogram scientific facility operated by the University of California (UC) for the U.S. Department of Energy (DOE). Berkeley Lab’s research is focused on the physical, biological, environmental, and computational sciences, with the objective of delivering scientific knowledge and discoveries pertinent to DOE’s mission. This annual report describes environmental protection activities and potential impacts resulting from operations conducted in calendar year 2021, unless otherwise indicated. The format and content of this report satisfy the requirements of both DOE Order 231.1B, Administrative Change 1 (Environment, Safety, and Health Reporting) (DOE, 2012) and the operating contract between UC and DOE (DOE Contract No. DE-AC02-05CH11231, also known as Contract 31).

54 ENVIRONMENTAL SCIENCES↗

The U.S. Department of Energy Computational Science Graduate Fellowship, 1991-2021: Follow-Up Study Shows Major Impact on Recipients and the Scientific Workforce

Since 1991, the U.S. Department of Energy Computational Science Graduate Fellowship (DOE CSGF) has addressed DOE National Laboratory needs as well as demands in the national workforce for trained professionals in computational science and engineering. Sponsored by the Department of Energy's Office of Science and the National Nuclear Security Administration, the DOE CSGF supports doctoral students in the pursuit of novel scientific or engineering discoveries using high-performance computing (HPC) resources. To meet the program’s core requirements, recipients participate in multidisciplinary studies, carry out at least one 12-week DOE laboratory research practicum, and contribute to an annual program review where the fellows present their research for sponsor review. The Krell Institute, which as managed the fellowship on behalf of the DOE since 1997, has commissioned several follow-up studies to examine the DOE CSGF recipients’ characteristics, fellows’ outcomes and professional accomplishments, alumni’s career paths and achievements, and recipients’ impact on national priorities through research and education.

97 MATHEMATICS AND COMPUTING↗

The U.S. Department of Energy Computational Science Graduate Fellowship, 1991-2021: Follow-Up Study Shows Major Impact on Recipients and the Scientific Workforce

Since 1991, the U.S. Department of Energy Computational Science Graduate Fellowship (DOE CSGF) has addressed DOE National Laboratory needs as well as demands in the national workforce for trained professionals in computational science and engineering. Sponsored by the Department of Energy's Office of Science and the National Nuclear Security Administration, the DOE CSGF supports doctoral students in the pursuit of novel scientific or engineering discoveries using high-performance computing (HPC) resources. To meet the program’s core requirements, recipients participate in multidisciplinary studies, carry out at least one 12-week DOE laboratory research practicum, and contribute to an annual program review where the fellows present their research for sponsor review. The Krell Institute, which as managed the fellowship on behalf of the DOE since 1997, has commissioned several follow-up studies to examine the DOE CSGF recipients’ characteristics, fellows’ outcomes and professional accomplishments, alumni’s career paths and achievements, and recipients’ impact on national priorities through research and education.

97 MATHEMATICS AND COMPUTING↗

Fusion Energy Sciences Network Requirements Review: Mild-cycle Update

The US Department of Energy (DOE) Office of Science (SC) world-class research infrastructure provides the research community with premier observational, experimental, computational, and network capabilities. Each user facility is designed to provide unique capabilities to advance core DOE mission science for its sponsor SC program and to stimulate a rich discovery and innovation ecosystem. Research communities gather and flourish around each user facility, bringing together diverse perspectives. The continual reinvention of the practice of science — as users and staff forge novel approaches expressed in research workflows — unlocks new discoveries and propels scientific progress.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗