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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 73 records · Page 4
All sourcesNASA NTRSDOE OSTI
DOE OSTI2026

Toward a standardization of cryostructure and cryogenic soil structure terminology for the field description of permafrost‐affected soils

This paper establishes standardized terminology and field documentation protocols for cryostructures and cryogenic soil structures in permafrost‐affected soils and provides brief guidance on descriptions of ground ice morphology and ice volume estimates. We consolidate permafrost terminology from Russian and North American literature, clarify long‐standing ambiguities, and provide explicit guidelines that align with US Department of Agriculture‐Natural Resources Conservation Service soil description standards. Our scheme makes critical distinctions between cryostructure, the distribution of ice within soil, and cryogenic soil structure, the morphological structure of soil resulting from ice formation. The scheme organizes cryostructures into three main categories: non‐segregated ice, visible segregated ice, and ice matrices. We introduce standardized codes and parameters for field descriptions of ice and soil that enable machine‐readable data collection compatible with existing soil information systems. This standardization will significantly enhance the integration of field observations into landscape‐scale assessments of permafrost stability, infrastructure vulnerability, and ecosystem response to permafrost thaw, addressing an urgent need for quantitative data to inform modeling and decision‐making in rapidly changing Arctic and subarctic environments.

Andersen, Megan L. [University of Minnesota, Saint↗
DOE OSTI2022

Fundamental Issues Identified for Thermodynamic Description of Molten Salt Systems

Thermodynamic modeling of the molten salt systems is critical in the design of advanced nuclear power plants, materials recycling, and many other important clean energy applications. As one of the most capable computational thermodynamic approaches, the CALPHAD (Calculation of Phase Diagrams) method has been widely used for multicomponent thermodynamic database development and further support more physics-based modeling. Although considerable CALPHAD modeling efforts for molten salt systems have been made, we found that no evaluation has been performed regarding the unary thermodynamic models for the molten salt systems despite the fact that more than one pure substance database is available for the CALPHAD modeling. Therefore, the thermodynamic descriptions of the pure salts should be critically evaluated to ensure a high-fidelity molten salt thermodynamic database. In this work, we comprehensively analyzed some selected molten salts using different available thermodynamic descriptions from two databases as an example. One is the SSUB database released by the SGTE (Scientific Group Thermodata Europe), and the other is the FactPS database from the FactSage. Finally, the significant discrepancies observed in the thermodynamic description between the existing CALPHAD pure substance databases and experiments call for an urgent effort to improve.

42 ENGINEERING↗
DOE OSTI2021

Catalytic site ensembles: A context to reexamine the Langmuir-Hinshelwood kinetic description

The Langmuir-Hinshelwood formalism describes catalytic reactions of Langmuirian surface species under the assumption that all adsorbates are randomly-distributed – enabling adjacency of surface-bound intermediates to be determined solely by coverages of single-site occupants. We demonstrate herein that this approximation is inappropriate even for simple catalytic reactions (e.g. A + A → A 2 ) and manifestly neglects islanding of slowly-consumed species and partitioning of highly-reactive species inherently engendered by ≥ two-site elementary steps (e.g. A*–A* → A 2(g) + *–*). Rigorous description of kinetically-consequential islanding/partitioning phenomena requires explicit description of the coverage and chemical dynamics of all multi-site ensembles. Higher-order, ensemble-specific rate terms identify the particular microscopic events relevant to each ensemble, and, in doing so, reveal that each elementary step (e.g. A (g) adsorption) describes not one event (e.g. A (g) + * → A*) , but a sum over all ensemble-specific paths (e.g. A (g) + *–* → A*–* and A (g) + A*–* → A*–A*). De-convoluting each elementary step into its constituent multi-site paths proffers kinetic detail otherwise inaccessible – enabling (i) identification of rate- and selectivity-determining site ensembles, (ii) calculation of rates and degrees of rate control of ensemble-specific elementary steps, (iii) incorporation of adsorbate surface diffusion, (iv) incorporation of lateral adsorbate interactions, and (v) quantitative description of catalysis of multi-site-occupying intermediates (e.g. *C n H m * species in hydrocarbon (de-)hydrogenation and C-C bond coupling/cleavage reactions) which we demonstrate here is inaccessible to the Langmuir-Hinshelwood formalism even if adsorbate surface diffusion is infinitely-fast.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2022

Density functional thermodynamic description of spin, phonon and displacement degrees of freedom in antiferromagnetic-to-paramagnetic phase transition in YNiO 3

This work herein demonstrates a direct density functional description of the finite-temperature thermodynamic properties of solids exhibiting phase transitions through positional and spin symmetry breaking degrees of freedom. A classic example addressed here is the rare-earth (R) nickelates RNiO 3 where the ground state is characterized by crystallographic and magnetic (e.g., antiferromagnetic) long-range order (LRO), whereas the higher temperature paramagnetic phase manifests a range of local spin and positional symmetry breaking motifs with short-range order (SRO). Unlike time-dependent simulations of spin and positional degrees of freedom, in the present work, phases are described via a superposition of static configurations constructed by populating a periodic base lattice supercell allowing for the formation of energy lowing distribution of positional and spin local motifs. The thermal populations of the configurations in such a superposition phase are obtained from the energy-minimized Density Functional Theory (DFT)-calculated partition functions at different temperatures. This approach offers flexible inclusion of different physical contributions to the free energy, such as elastic, electronic and phonon free energies, all obtained from the same underlying DFT total energy calculations of periodic structures. The thermodynamic and magnetic properties of both LRO and SRO crystallographic and spin phases, including antiferromagnetic (AFM) to paramagnetic (PM) Néel phase transition in YNiO3 are studied. Including spin and phonon contributions, we find a DFT-calculated Néel temperature to be 144 K in satisfactory agreement with the experimental value of 145 K; whereas omitting the phonon contribution, one obtains a Néel temperature of 81 K. We present phonon contributions to the DFT-calculated temperature-dependent SRO, heat capacities, and the polymorphous distribution of nonzero local magnetic moments in the PM phase. This approach thus extends to finite temperatures the symmetry-broken DFT description of both the AFM and PM phases, demonstrating that a thermodynamic superposition approach based on symmetry broken configurations evaluated by a mean-field like DFT is sufficient to obtain a consistent description of the thermal physics of the AFM, PM phases and their interconversion in 3d oxides illustrated by YNiO 3 .

36 MATERIALS SCIENCE↗
DOE OSTI2025

Toward a Balanced Description of Ground and Excited States with Transcorrelated F12 Methods

By correlating only the 1-particle states occupied in the reference determinant, the conventional design for the single-reference R12/F12 explicitly correlated methods biases them toward the ground-state description, thereby making the treatment of response properties of the ground state, and energies and other properties of excited states less robust. While the use of multireference methods and/or extensions of the standard SP-projected geminals can achieve a more balanced description of ground and excited states, here we show that the same goals can be achieved by extending the action of F12 correlators to the occupied and valence unoccupied 1-particle states only. This design choice reflects the strong dependence of the optimal correlation length scale of the F12 ansatz on the orbital energies/structure, and helps to avoid the unphysical raising of the ground-state energy if the F12 geminals are used to correlate pairs of all 1-particle states. The improved F12 geminal design is incorporated into the unitary transcorrelation framework to produce a unitary 2-body Hamiltonian that incorporates the short-range dynamical correlation physics for ground and low-energy excited states in a balanced manner. This explicitly correlated effective Hamiltonian reduces the basis set requirement on the correlation-consistent basis cardinal number by 1 or more over the uncorrelated counterpart for the description of ground-state coupled-cluster singles and doubles (CCSD) energies, vertical excitation energies, and harmonic vibrational frequencies of equation-of-motion CCSD low-energy excited states.

Hamiltonians↗
DOE OSTI2020

Towards yeast taxogenomics: lessons from novel species descriptions based on complete genome sequences

In recent years, ‘multi-omic’ sciences have affected all aspects of fundamental and applied biological research. Yeast taxonomists, though somewhat timidly, have begun to incorporate complete genomic sequences into the description of novel taxa, taking advantage of these powerful data to calculate more reliable genetic distances, construct more robust phylogenies, correlate genotype with phenotype and even reveal cryptic sexual behaviors. Furthermore, the use of genomic data in formal yeast species descriptions is far from widespread. The present review examines published examples of genome-based species descriptions of yeasts, highlights relevant bioinformatic approaches, provides recommendations for new users and discusses some of the challenges facing the genome-based systematics of yeasts.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2025

Quantum description of wave dark matter

We outline a fundamentally quantum description of bosonic dark matter (DM) from which the conventional classical-wave picture emerges in the limit 𝑚 ≪10 eV. As appropriate for a quantum system, we start from the density matrix, which encodes the full information regarding the possible measurements we could make of DM and their fluctuations. Following fundamental results in quantum optics, we argue that for DM it is most likely that the density matrix takes the explicitly mixed form of a Gaussian over the basis of coherent states. Deviations from this would generate non-Gaussian fluctuations in DM observables, allowing a direct probe of the quantum state of DM. Our quantum optics–inspired approach allows us to rigorously define and interpret various quantities that are often only described heuristically, such as the coherence time or length. The formalism further provides a continuous description of DM through the wave-particle transition, which we exploit to study how density fluctuations over various physical scales evolve between the two limits and to reveal the unique behavior of DM near the boundary of the wave and particle descriptions.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2020

Low-Activity Waste Melter Process (LMP) System Design Description (Rev. 4)

This system design description (SDD) defines the technical, functional, and performance requirements of the low-activity waste (LAW) melter process system (LMP). This document details the waste treatment requirements, environmental compliance requirements, and authorization basis requirements of the LMP system as they are currently known and understood. This SDD describes the process and functional design requirements of the LMP, including the following: 1) Services and utility requirements, operating materials and supplies, and other external interfaces; 2) Operations limits and design bases; 3) Other criteria and requirements pertinent to the design of the LMP system; 4) Boundaries, system interfaces, and functional description of the LMP system. The LMP system is composed of two LAW melters of the same design with the contingency to add the third. Also included in the LMP system are the pour spouts, which are positioned under the melter discharge chambers of each melter, and the container level detectors. The boundaries, system interfaces, and functional description of the LMP system are provided in Section 2.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2020

Analysis Description Languages for the LHC

An analysis description language is a domain specific language capable of describing the contents of an LHC analysis in a standard and unambiguous way, independent of any computing framework. It is designed for use by anyone with an interest in, and knowledge of, LHC physics, i.e., experimentalists, phenomenologists and other enthusiasts. Adopting analysis description languages would bring numerous benefits for the LHC experimental and phenomenological communities ranging from analysis preservation beyond the lifetimes of experiments or analysis software to facilitating the abstraction, design, visualization, validation, combination, reproduction, interpretation and overall communication of the analysis contents. Here, we introduce the analysis description language concept and summarize the current efforts ongoing to develop such languages and tools to use them in LHC analyses.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
NASA NTRS1971

A method for determining the response of space shuttle to atmospheric turbulence. Volume 2: Computer program description and usage instructions

A description is given of a computer program which calculates the response of an elastic aerospace vehicle to random and discrete turbulence. The program uses vibration modes as generalized coordinates. Inputs to the program include modal information, generalized aerodynamic forces, flight data, stability augmentation system description, and description of the disturbing function. Program outputs include tabulations of the ratio of root-mean-square response to root-mean-square turbulence and response upward zero crossings per second, and SC4020 plots of transfer functions, response power spectral densities, and Nyquist stability traces.

Huntington, R.↗
NASA NTRS1982

Descriptions of stony meteorites

The individual specimens, arranged by class are described. Within the chondrites, the specimens are grouped according to the Van Schmus-Wood classification, and the descriptions follow the order of increasing petrographic type. The original weight of the specimen is given to the nearest gram (nearest 0.1 gram for specimens weighing less than 100 grams). Material on al characterized meteorites collected together with descriptions of some meteorites is included. Specimens weighing less than 100 grams are listed without descriptions, unless they show distinctive features.

Score, R.↗
NASA NTRS1983

A standard description and costing methodology for the balance-of-plant items of a solar thermal electric power plant. Report of a multi-institutional working group

Standard descriptions for solar thermal power plants are established and uniform costing methodologies for nondevelopmental balance of plant (BOP) items are developed. The descriptions and methodologies developed are applicable to the major systems. These systems include the central receiver, parabolic dish, parabolic trough, hemispherical bowl, and solar pond. The standard plant is defined in terms of four categories comprising (1) solar energy collection, (2) power conversion, (3) energy storage, and (4) balance of plant. Each of these categories is described in terms of the type and function of components and/or subsystems within the category. A detailed description is given for the BOP category. BOP contains a number of nondevelopmental items that are common to all solar thermal systems. A standard methodology for determining the costs of these nondevelopmental BOP items is given. The methodology is presented in the form of cost equations involving cost factors such as unit costs. A set of baseline values for the normalized cost factors is also given.

Source record↗
NASA NTRS1990

On the use of Lagrangian variables in descriptions of unsteady boundary-layer separation

The Lagrangian description of unsteady boundary layer separation is reviewed from both analytical and numerical perspectives. It is explained in simple terms how particle distortion gives rise to unsteady separation, and why a theory centered on Lagrangian coordinates provides the clearest description of this phenomenon. Some of the more recent results for unsteady three dimensional compressible separation are included. The different forms of separation that can arise from symmetries are emphasized. A possible description of separation is also included when the detaching vorticity layer exits the classical boundary layer region, but still remains much closer to the surface than a typical body-lengthscale.

Cowley, Stephen J.↗
NASA NTRS1991

Description and interpretation of aircraft lightning attachment electric and magnetic field measurements and video observation

In 1988, ONERA carried out a complete airborne lightning characterization program. Among other features, the program has provided a significant amount of data from analog records of electric and magnetic field sensors to give a description of all stages of the lightning process. The initiation phase has a description of all stages of the lightning process. The initiation phase has been described in the past, so the present objective is to give a description of the other stages of the discharge, based on the observation of analog electromagnetic waveforms and of fast video (200 f/s) image processed pictures. During lightning attachment, the aircraft remains electrically connected to the lightning channel where a large variety of physical processes occur. These physical processes include recoil streamers, return strokes, and even other initiation processes of secondary discharges. Typical records of analog electromagnetic field along with relative luminosity variation of the channel, which shows that there is no extinction of the continuous current throughout the discharge process. A computation of current and potential waveforms using the transmission line formalism is presented and gives satisfactory results for the representation of two of the typical waveforms observed in the recoil streamer processes.

Moreau, J. P.↗
NASA NTRS1991

Description of the PMAD DC test bed architecture and integration sequence

NASA-Lewis is responsible for the development, fabrication, and assembly of the electric power system (EPS) for the Space Station Freedom (SSF). The SSF power system is radically different from previous spacecraft power systems in both the size and complexity of the system. Unlike past spacecraft power system the SSF EPS will grow and be maintained on orbit and must be flexible to meet changing user power needs. The SSF power system is also unique in comparison with terrestrial power systems because it is dominated by power electronic converters which regulate and control the power. Although spacecraft historically have used power converters for regulation they typically involved only a single series regulating element. The SSF EPS involves multiple regulating elements, two or more in series, prior to the load. These unique system features required the construction of a testbed which would allow the development of spacecraft power system technology. A description is provided of the Power Management and Distribution (PMAD) DC Testbed which was assembled to support the design and early evaluation of the SSF EPS. A description of the integration process used in the assembly sequence is also given along with a description of the support facility.

Beach, R. F.↗
NASA NTRS1991

Description of the PMAD DC test bed architecture and integration sequence

NASA-LEWIS is responsible for the development, fabrication, and assembly of the electric power system (EPS) for the Space Station Freedom (SSF). The SSF power system is radically different from previous spacecraft power systems in both the size and complexity of the system. Unlike past spacecraft power systems, the SSF EPS will grow and be maintained on orbit and must be flexible to meet challenging user power needs. The SSF power system is also unique in comparison with terrestrial power systems because it is dominated by power electronic converters which regulate and control the power. A description is provided of the Power Management and Distribution DC Testbed which was assembled to support the design and early evaluation of the SSF EPS. A description of the integration process used in the assembly sequence is also given along with a description of the support facility.

Beach, R. F.↗
NASA NTRS2003

A Domain Description Language for Data Processing

We discuss an application of planning to data processing, a planning problem which poses unique challenges for domain description languages. We discuss these challenges and why the current PDDL standard does not meet them. We discuss DPADL (Data Processing Action Description Language), a language for describing planning domains that involve data processing. DPADL is a declarative, object-oriented language that supports constraints and embedded Java code, object creation and copying, explicit inputs and outputs for actions, and metadata descriptions of existing and desired data. DPADL is supported by the IMAGEbot system, which we are using to provide automation for an ecological forecasting application. We compare DPADL to PDDL and discuss changes that could be made to PDDL to make it more suitable for representing planning domains that involve data processing actions.

Golden, Keith↗