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DOE OSTI2024

Methods of Securing Chemical and Pharmaceutical Knowledge and Recommendations for International Institutions to Enhance Research Integrity

Here, this paper examines strategies for securing chemical and pharmaceutical expertise in a globalized research environment, focusing on safeguarding intellectual property and preventing the misuse of sensitive and potentially dual-use information. The product of collective efforts between Pacific Northwest National Laboratory, Carol Davila University of Medicine and Pharmacy, and New Bulgarian University, highlights the challenges and opportunities posed by cross-border research collaborations, particularly in the context of differing regulatory frameworks and research cultures. It explores current mechanisms to prevent data loss and unauthorized access to sensitive information while assessing the effectiveness of existing security measures, frameworks, and international export control regimes. The approach examines the differing methodologies for promoting transparency, trust-building, and mutual accountability in joint research projects to cultivate secure data-sharing practices and intellectual property. It provides recommendations for international institutions to implement security guidelines in framing research priorities, encourages continual training and education programs, and the integration of processes for monitoring research compliance. This partnership aims to advance scientific innovation while maintaining global stability, ensuring compliance with international norms, and safeguarding valuable intellectual property as measures in chemical and pharmaceutical research security practices continue to expand due to international collaboration and knowledge exchange.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2025

Advancing ocean monitoring and knowledge for societal benefit: the urgency to expand Argo to OneArgo by 2030

The ocean plays an essential role in regulating Earth’s climate, influencing weather conditions, providing sustenance for large populations, moderating anthropogenic climate change, encompassing massive biodiversity, and sustaining the global economy. Human activities are changing the oceans, stressing ocean health, threatening the critical services the ocean provides to society, with significant consequences for human well-being and safety, and economic prosperity. Effective and sustainable monitoring of the physical, biogeochemical state and ecosystem structure of the ocean, to enable climate adaptation, carbon management and sustainable marine resource management is urgently needed. The Argo program, a cornerstone of the Global Ocean Observing System (GOOS), has revolutionized ocean observation by providing real-time, freely accessible global temperature and salinity data of the upper 2,000m of the ocean (Core Argo) using cost-effective simple robotics. For the past 25 years, Argo data have underpinned many ocean, climate and weather forecasting services, playing a fundamental role in safeguarding goods and lives. Argo data have enabled clearer assessments of ocean warming, sea level change and underlying driving processes, as well as scientific breakthroughs while supporting public awareness and education. Building on Argo’s success, OneArgo aims to greatly expand Argo’s capabilities by 2030, expanding to full-ocean depth, collecting biogeochemical parameters, and observing the rapidly changing polar regions. Providing a synergistic subsurface and global extension to several key space-based Earth Observation missions and GOOS components, OneArgo will enable biogeochemical and ecosystem forecasting and new long-term climate predictions for which the deep ocean is a key component. Driving forward a revolution in our understanding of marine ecosystems and the poorly-measured polar and deep oceans, OneArgo will be instrumental to assess sea level change, ocean carbon fluxes, acidification and deoxygenation. Emerging OneArgo applications include new views of ocean mixing, ocean bathymetry and sediment transport, and ecosystem resilience assessment. Implementing OneArgo requires about $100 million annually, a significant increase compared to present Argo funding. OneArgo is a strategic and cost-effective investment which will provide decision-makers, in both government and industry, with the critical knowledge needed to navigate the present and future environmental challenges, and safeguard both the ocean and human wellbeing for generations to come.

ARGO↗
DOE OSTI2026

Domain Knowledge Guided Bayesian Optimization For Autonomous Alignment Of Complex Scientific Instruments

Bayesian Optimization (BO) is a powerful tool for optimizing complex non-linear systems. However, its performance degrades in high-dimensional problems with tightly coupled parameters and highly asymmetric objective landscapes, where rewards are sparse. In such needle-in-a-haystack scenarios, even advanced methods like trust-region BO (TurBO) often lead to unsatisfactory results. We propose a domain knowledge guided Bayesian Optimization approach, which leverages physical insight to fundamentally simplify the search problem by transforming coordinates to decouple input features and align the active subspaces with the primary search axes. We demonstrate this approach's efficacy on a challenging 12-dimensional, 6-crystal Split-and-Delay optical system, where conventional approaches, including standard BO, TuRBO and multi-objective BO, consistently led to unsatisfactory results. When combined with an reverse annealing exploration strategy, this approach reliably converges to the global optimum. The coordinate transformation itself is the key to this success, significantly accelerating the search by aligning input co-ordinate axes with the problem's active subspaces. As increasingly complex scientific instruments, from large telescopes to new spectrometers at X-ray Free Electron Lasers are deployed, the demand for robust high-dimensional optimization grows. Our results demonstrate a generalizable paradigm: leveraging physical insight to transform high-dimensional, coupled optimization problems into simpler representations can enable rapid and robust automated tuning for consistent high performance while still retaining current optimization algorithms.

FOS: Computer and information sciences↗
DOE OSTI2026

Impact of atmospheric turbulence on performance and loads of wind turbines: knowledge gaps and research challenges

Wind energy harvesting from the atmosphere takes place in the atmospheric boundary layer. The boundary layer shear and buoyancy create three-dimensional turbulent eddies spanning a range of scales that form a continuous forward cascade of kinetic energy to the smallest scales of motion where energy is dissipated. Large-scale atmospheric circulations modulate the boundary layer turbulence, characterized by coherence and intermittency. As wind turbines grow in size and the integrated control of both turbines and wind farms spans greater distances, the relationship between the scales of atmospheric turbulence and the design and operation of wind energy facilities has entered new territory. The boundary layer turbulence impacts both wind turbine power production and turbine loads. Optimizing wind turbine and wind farm performance requires an understanding of how turbulence affects both wind turbine efficiency and reliability. While the characteristics of atmospheric boundary layer turbulence have been observed and studied in detail over the last few decades, there are still significant gaps in our understanding of the impact of turbulence on wind power resources and wind farm operations. This paper outlines the current state of turbulence research relevant to wind energy applications and points to gaps in our knowledge that need to be addressed to effectively utilize wind resources.

Kosović, Branko [Johns Hopkins Univ., Baltimore, M↗
NASA NTRS1972

Objective estimates based on experimental data and initial and final knowledge

An extension of the method of Jaynes, whereby least biased probability estimates are obtained, permits such estimates to be made which account for experimental data on hand as well as prior and posterior knowledge. These estimates can be made for both discrete and continuous sample spaces. The method allows a simple interpretation of Laplace's two rules: the principle of insufficient reason and the rule of succession. Several examples are analyzed by way of illustration.

Rosenbaum, B. M.↗
NASA NTRS1974

New space technology advances knowledge of the remote polar regions

The application of ERTS-1 imagery is rapidly increasing man's knowledge of polar regions. Products compiled from this imagery at scales of 1:250,000, 1:500,000 and 1:1,000,000 are already providing valuable information to earth scientists working in Antarctica. Significant finds detected by these bench mark products were glaciological changes, advancement in ice fronts, discovery of new geographic features, and the repositioning of nunataks, islands, and ice tongues. Tests conducted in Antarctica have proven the feasibility of tracking Navy navigation satellites to establish ground control for positioning ERTS-1 imagery in remote areas. ERTS imagery coupled with satellite geodesy shows great promise and may prove to be the most practical and cost effective way to meet the small-scale cartographic requirements of the polar science community.

Macdonald, W. R.↗
NASA NTRS1974

Recent improvements in our knowledge of neutral atmosphere structure from satellite drag measurements

Observational results on the density in the thermosphere and lower exosphere (i.e., within the altitude range from about 150 to about 1000 km) are discussed in this paper. Most observational results on total gas density were obtained from orbital drag and more recently also from in-situ drag analysis. The primary parameter measured is atmospheric density, with temperature as a secondary structural parameter deduced with the help of theory and/or atmospheric models. Both the merits and shortcomings of the drag analysis method are outlined in view of a comparison of temperature deduced from total density and kinetic gas temperature measured by incoherent scatter. Recent improvements of our knowledge of the known density variations are presented.

Roemer, M.↗
NASA NTRS1978

The rings of Saturn: State of current knowledge and some suggestions for future studies

The state of our current knowledge of the properties of the ring system as a whole, and of the particles individually, is assessed. Attention is primarily devoted to recent results and possibilities for exploration of the ring system by a Saturn orbiter. In particular, the infrared and microwave properties of the ring system are discussed. The behavior of the ring brightness is not well understood in the critical transition spectral region from approximately 100 micrometers to approximately 1 cm. Also, the dynamical behavior of the ring system is discussed. Recent theoretical studies show that ongoing dynamical effects continually affect the ring structure in azimuth (possibly producing the A ring brightness asymmetry) and in the vertical direction. Orbital spacecraft-based studies of the rings will offer several unique advantages and impact important cosmogonical questions. Bistatic radar studies and millimeter-wavelength spectrometer/radiometry will give particle sizes and composition limits needed to resolve the question of the density of the rings, and provide important boundary conditions on the state of Saturn's protoplanetary nebula near the time of planetary formation.

Cuzzi, J. N.↗
NASA NTRS1979

Diffusion and utilization of scientific and technological knowledge within state and local governments

The state-of-the-art is reviewed concerning current knowledge of processes by which technological innovation and scientific information are disseminated among state and local governments. The effectiveness of various mechanisms, strategies, and approaches by which federal agencies have sought to transfer technology to state, regional, and city governments are assessed. It is concluded that the existing relationships between the state and local governments, and the scientific communities are not adequate.

Feller, I.↗
NASA NTRS1978

Status of knowledge of the extraterrestrial solar 'constant' and spectral distribution

Current knowledge of the total solar flux (the solar constant) and its spectral distribution at the top of the earth's atmosphere is reviewed. The development of pyrheliometers and radiation scales is traced, noting that active cavity pyrheliometers have been developed to reduce measurement uncertainty to within 0.1/%. The weighted mean solar constant from ground-based, aircraft, balloon, spacecraft and sounding rocket observations has been calculated to be 1369 W/sq m. Future observations are planned in order to reduce uncertainty to the 0.1% level required for climatological studies. A comparison of the measurement and models of solar spectral irradiance obtained by Thekaekara (1969, 1974), Arvesen (1969) and Labs and Neckel (1968, 1975) shows that the spectrum of Labs and Neckel is most accurate in the 0.4 to 1.25 micron range, that of Arvesen is best in the 0.3 to 0.4 abd 1.25 to 2.5 micron ranges and the model of Labs and Neckel is best at wavelengths greater than 2.5 microns.

Willson, R. C.↗
NASA NTRS1980

Evaluation of existing knowledge of the tectonic history and lithospheric structure of South America

While data is available on the lithospheric and crustal structure of the Andes region of South America, there is limited knowledge of these aspects of the eastern portion of the continent. For this reason, a surface wave dispersion study of the area was initiated. Long period seismograms were obtained for a tripartite analysis of dispersion. A flow chart of the analysis to be conducted is presented along with a preliminary geologic/tectonic map that was prepared. Efforts to characterize the provinces identified in terms of their geological and geophysical parameters continue.

Keller, G. R.↗
NASA NTRS1984

Some contributions to knowledge of the magnetospheric plasma by ISEE investigators

The ISEE project has made substantial contributions to the knowledge of the magnetosphere during the period of the IMS, especially in the discipline of Space Plasma Physics. Results obtained during approximately the first two years of the operation of ISEE-1 and -2, and touches on relevant results of ISEE-3 are reviewed. The ability to control the separation between ISEE-1 and -2, which are in nearly identical orbits, has permitted study of the motion and structure of the bow shock and magnetopause, the boundary layers, and the plasma sheet. Much evidence was obtained favoring the existence of reconnection and its relevance to the transfer of magnetic flux from the frontside to the rear of the magnetosphere, although not everyone agrees that it is the only important process. The presence of both reflected and accelerated particles was shown to lead to the development of a foreshock region between the bow shock and the interplanetary magnetic field line tangential to it.

Ogilvie, K. W.↗
NASA NTRS1984

Knowledge Based Engineering for Spatial Database Management and Use

The use of artificial intelligence techniques that are applicable to Geographic Information Systems (GIS) are examined. Questions involving the performance and modification to the database structure, the definition of spectra in quadtree structures and their use in search heuristics, extension of the knowledge base, and learning algorithm concepts are investigated.

Peuquet, D.↗
NASA NTRS1983

Manned spaceflight activity planning with knowledge-based systems

An on-board expert system, capable of assisting with crew-activity planning and platform-status monitoring, could provide unprecedented autonomy to the crew of a permanently manned space station. To demonstrate this concept's feasibility, an existing knowledge-based system is adapted to support Space Shuttle crew-activity timeline planning. Proposed timeline changes are to be checked for compliance with crew capabilities and mission operating guidelines, so that a nonexpert can be guided through a successful plan modification. Early lessons that have been learned about the scope of the adaptation needed to achieve this objective are presented.

Mogilensky, J.↗
NASA NTRS1983

The effects of level of knowledge upon human problem solving in a process control task

The effect of knowledge of a system on the performance of the operator has been investigated using PLANT, a generic simulation of a process. Four sets of written instructions representing the what, how, and why of system control were utilized by groups of subjects who controlled PLANT in a variety of familiar and unfamiliar situations. Written test results at the end of the experiments showed that the instructions had no effect on the primary goal of production, but those groups receiving guidelines for operation (the how) controlled the system in a more stable manner. Principles (the why) had no apparent effect on the subjects' performance. There was no difference between groups in diagnosing unfamiliar events.

Morris, N. M.↗
NASA NTRS1984

Some contributions to knowledge of the magnetospheric plasma by ISEE-1 investigators

The ability to control the separation between ISEE-1 and 2 permitted study of the motion and structure of the bow shock and magnetopause, the boundary layers, and the plasma sheet. Evidence favoring the existence of reconnection and its relevance to the transfer of magnetic flux from the frontside to the rear of the magnetosphere, was obtained. The presence of reflected and accelerated particles is shown to lead to the development of a foreshock region between the bow shock and the interplanetary magnetic field line tangential to it. Precursors to interplanetary shocks are also observed. Inside the magnetosphere, ISEE contributed to knowledge of plasma waves, and, augmenting work with GEOS, to studies of plasma composition. In the near tail, the boundary layer of the plasma sheet disclosed interesting phenomena.

Ogilive, K. W.↗