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At least 55 records · Page 3

All sources NASA NTRS DOE OSTI

NASA NTRS1962

A Preliminary Theoretical Study of the Expansion Tube, a New Device for Producing High-Enthalpy Short-Duration Hypersonic Gas Flows

A preliminary theoretical study was conducted of a new technique for producing high-enthalpy gas flows. The device considered utilizes an unsteady expansion process for the purpose of total-enthalpy multiplication. Analyses were conducted for both perfect and real air in equilibrium, assuming idealized diaphragm bursts, centered expansion waves, and continuum flow. Results of the study showed the expansion tube capable of outperforming the conventional shock tunnel by a factor of approximately 2 in velocity for the same test-section ambient density and pressure. The degree of dissociation is low at all phases of the thermodynamic cycle in the expansion tube; thus the test-section air has a good possibility of being in equilibrium. Maximum pressures involved in the cycle for duplicating a typical reentry from, a lunar mission are low enough for existing pressure-vessel techniques. Both the known and anticipated advantages and disadvantages of this new concept are also discussed.

TUBING↗

NASA NTRSDate not supplied

BEAST: Expanding Sustainable Data Infrastructure for High-Enthalpy Facilities

Reproducible, data-driven thermal protection system (TPS) research requires that experimental records from high-enthalpy testing be consistently structured, traceable, and accessible across campaigns and institutions. In practice, however, arcjet and plasma facilities data remain largely fragmented: raw diagnostics are stored in ad hoc formats, material sample histories are disconnected from test conditions, and metadata standards are absent, precluding systematic cross-campaign analysis and long-term reuse. BEAST (Backend for Experiment Analysis, Storage, and Traceability) is an open-source, web-based platform that addresses these limitations by providing a unified, queryable infrastructure for high-enthalpy ground-test data [1]. First presented at the 15th Ablation Workshop [2], BEAST has since undergone significant development. The platform ingests and structures multi-channel time-series diagnostics, facility configurations, and material property records within a common provenance model, ensuring end-to-end traceability from raw sensor acquisition to reduced experimental quantities. A versioned material library links specimen identity and processing history to the specific runs in which each sample was tested. An integrated modeling workbench enables training and evaluation of regression models directly on archived experimental data, supporting condition interpolation and the construction of empirical material response databases. Beyond its original deployment at NASA Ames Research Center, BEAST has been designed to be facility-agnostic, with ongoing efforts to extend its adoption to other facilities. Its modular architecture accommodates heterogeneous diagnostic setups and facility types, and its future open-source distribution allows institutions to build on a common data standard rather than maintaining isolated, bespoke solutions. BEAST is further integrated within a broader ecosystem of companion tools: arcjetCV [3] extracts recession rates and shock standoff distances from high-speed video using computer vision, and miniSTARscan [4] provides sub-minute, portable photogrammetric surface reconstruction of test articles before and after exposure. All tools share a common data schema, enabling seamless ingestion of surface geometry, imagery, and time-series data into a single, coherent experimental record.

Database↗

NASA NTRSDate not supplied

BEAST: Expanding Sustainable Data Infrastructure for High-Enthalpy Facilities

Database↗

DOE OSTI2024

Mixed Enthalpy–Entropy Descriptor for the Rational Design of Synthesizable High-Entropy Materials Over Vast Chemical Spaces

The practically unlimited high-dimensional composition space of high-entropy materials (HEMs) has emerged as an exciting platform for functional material design and discovery. However, the identification of stable and synthesizable HEMs and robust design rules remains a daunting challenge. Here, we propose a mixed enthalpy–entropy descriptor (MEED) that enables highly efficient, robust, high-throughput prediction of synthesizable HEMs across vast chemical spaces from first-principles. The MEED is based on two parameters: the relative formation enthalpy with respect to the most stable competing compound and the spread of the point-defect formation energy spectrum. The former measures the relative synthesizability of an HEM to its most stable competing phase, going beyond the conventional thermodynamic understanding. Further, the latter gauges the relative entropy forming ability of an HEM, entailing no sampling over numerous alloy configurations. By applying the MEED to two structurally distinct representative material systems (i.e., 3D rocksalt carbides and 2D layered sulfides), we not only successfully identify all experimentally reported HEMs within these systems but also reveal a cutoff criterion for assessing their relative synthesizability within each system. By the MEED, tens of new high-entropy carbides and 2D high-entropy sulfides are also predicted, which have the potential for a wide variety of applications such as coating in aerospace devices, energy conversion and storage, and flexible electronics.

36 MATERIALS SCIENCE↗

DOE OSTI2023

Enthalpy-uphill exciton dissociation in organic/2D heterostructures promotes free carrier generation

Despite the large binding energy of charge transfer (CT) excitons in type-II organic/2D heterostructures, it has been demonstrated that free carriers can be generated from CT excitons with a long lifetime. Using a model fluorinated zine phthalocyanine (F 8 ZnPc)/monolayer-WS 2 interface, we find that CT excitons can dissociate spontaneously into free carriers despite it being an enthalpy-uphill process. Specifically, it is observed that CT excitons can gain an energy of 250 meV in 50 ps and dissociate into free carriers without any applied electric field. This observation is surprising because excited electrons typically lose energy to the environment and relax to lower energy states. Here, we hypothesize that this abnormal enthalpy-uphill CT exciton dissociation process is driven by entropy gain. Kinetically, the entropic driving force can also reduce the rate for the reverse process – the conversion of free electron–hole pairs back to CT excitons. Hence, this mechanism can potentially explain the very long carrier lifetime observed in organic/2D heterostructures.

36 MATERIALS SCIENCE↗

DOE OSTI2022

An evaluation for geometries, formation enthalpies, and dissociation energies of diatomic and triatomic (C, H, N, O), NO 3 , and HNO 3 molecules from the PAW DFT method with PBE and optB88-vdW functionals

The structural geometries, formation enthalpies, and dissociation energies of all diatomic and triatomic molecules consisting of the four basic elements C, H, N, and/or O are calculated using the projector augmented wave density functional theory (DFT) method with the Perdew–Burke–Ernzerhof and optB88-vdW exchange-correlation functionals. The calculations are also extended to two larger molecules NO 3 and HNO 3 , which consist of four and five atoms, respectively. In total, 82 molecules or isomers are considered in the calculations. The geometric parameters including 42 bond lengths and 15 bond angles of these molecules calculated using the planewave DFT method are highly satisfactory, relative to the available experimental data. The error analysis is also performed for 49 formation enthalpies and 138 dissociation energies (including 51 atomization energies as well as the corresponding bond dissociation energies). The results are also compared with the previous data from various atomic-orbital-based methods for molecules and from similar or different planewave DFT methods for various solids and other molecules. This provides an informative and instructive evaluation especially for calculating the large-size material systems containing these small molecules as well as for developing the DFT methods further.

74 ATOMIC AND MOLECULAR PHYSICS↗

DOE OSTI2023

Enthalpies of formation for Criegee intermediates: A correlation energy convergence study

Criegee intermediates, formed from the ozonolysis of alkenes, are known to have a role in atmospheric chemistry, including the modulation of the oxidizing capacity of the troposphere. Although studies have been conducted since their discovery, the synthesis of these species in the laboratory has ushered in a new wave of investigations of these structures, both theoretically and experimentally. In some of these theoretical studies, high-order corrections for correlation energy are included to account for the mid multi-reference character found in these systems. Many of these studies include a focus on kinetics; therefore, the calculated energies should be accurate (<1 kcal/mol in error). In this research, we compute the enthalpies of formation for a small set of Criegee intermediates, including higher-order coupled cluster corrections for correlation energy up to coupled cluster with perturbative quintuple excitations. The enthalpies of formation for formaldehyde oxide, anti-acetaldehyde oxide, syn-acetaldehyde oxide, and acetone oxide are presented at 0 K as 26.5, 15.6, 12.2, and 0.1 kcal mol−1, respectively. Additionally, we do not recommend the coupled cluster with perturbative quadruple excitations [CCSDT(Q)] energy correction, as it is approximately twice as large as that of the coupled cluster with full quadruple excitations (CCSDTQ). Half of the CCSDT(Q) energy correction may be included as a reliable, cost-effective estimation of CCSDTQ energies for Criegee intermediates.

Chemistry↗

DOE OSTI2023

Interpreting T-History Data on Supercooling and Phase Change Enthalpy of a Salt-Hydrogel Complex for Building Thermal Management

Phase change materials (PCMs) are promising materials for storing and discharging latent heat in buildings to regulate the thermal environment. Measurement of salt hydrate PCM thermal performance is often challenging because of supercooling and phase segregation. Though differential scanning calorimetry (DSC) has been widely used to measure thermal properties of various phase change materials, DSC uses milligrams of sample and is unrealistic for predicting large-scale materials performance. The T-history method [1], in contrast, handles higher volumes but the analysis typically requires a lumped capacitance assumption. Here, we report and analyze T-History data on a novel salt-hydrogel complex with high viscosity, that renders low Biot number sample preparation extremely challenging. We re-examine the standard T-history method and compared against DSC data in this complex material. We report details of an experimental setup, built with necessary additions to a controlled environmental chamber. We carefully examine the validity of the lumped capacitance assumption and suggest a modified analysis using a computational approach for reliable data. Experimental parameters such as ramp rate and temperature range of the environmental chamber are considered via computational modeling to understand the effect of ramp rate on supercooling [2]. Finally, we report thermal cycling experiments on the salt-hydrogel complex. Our modified approach to measuring supercooling and enthalpy of fusion at large scales is important in better understanding the performance of phase-change materials at scale for building thermal storage. References: [1] Marin, Jose M, Belen Zalba, Luisa F Cabeza, and Harald Mehling. “Determination of Enthalpy Temperature Curves of Phase Change Materials with the Temperature-History Method: Improvement to Temperature Dependent Properties.” Measurement Science and Technology 14, no. 2 (February 1, 2003): 184–89. https://doi.org/10.1088/0957-0233/14/2/305. [2] Safari, A., R. Saidur, F.A. Sulaiman, Yan Xu, and Joe Dong. “A Review on Supercooling of Phase Change Materials in Thermal Energy Storage Systems.” Renewable and Sustainable Energy Reviews 70 (April 2017): 905–19. https://doi.org/10.1016/j.rser.2016.11.272

thermodynamics↗

NASA NTRS1982

Results of variable enthalpy tests of CPR-488 TIP panels in MSFC Hot Gas Facility

Tests were conducted to determine the effects of variable enthalpy levels on CPR-488 foam performance and/or recession. Also to be determined was whether the BX-250 thickness indicator plugs (TIP) concept is feasible for measuring recession rates of CPR-488 foam during external tank flight. The tests determined that the TIP plug idea works. The accuracy of the indicated recession depth is approximately + or - 1.16 in. The BX-250 plugs with TiO2 work better than the regular BX-250 plugs. Also, there is an effect of enthalpy on CPR-488 foam performance.

Dean, W. G.↗

NASA NTRS1989

A numerical analysis of Stefan problems for generalized multi-dimensional phase-change structures using the enthalpy transforming model

An enthalpy transforming scheme is proposed to convert the energy equation into a nonlinear equation with the enthalpy, E, being the single dependent variable. The existing control-volume finite-difference approach is modified so it can be applied to the numerical performance of Stefan problems. The model is tested by applying it to a three-dimensional freezing problem. The numerical results are in agreement with those existing in the literature. The model and its algorithm are further applied to a three-dimensional moving heat source problem showing that the methodology is capable of handling complicated phase-change problems with fixed grids.

Cao, Yiding↗

NASA NTRS1990

Enthalpy damping for high Mach number Euler solutions

An improvement on the enthalpy damping procedure currently in use in solving supersonic flow fields is described. A correction based on entropy values is shown to produce a very efficient scheme for simulation of high Mach number three-dimensional flows. Substantial improvements in convergence rates have been achieved by incorporating this enthalpy damping scheme in a finite-volume Runge-Kutta method for solving the Euler equations. Results obtained for blended wing-body geometries at very high Mach numbers are presented.

Moitra, Anutosh↗

NASA NTRS1992

Heat flux and shock shape measurements on an Aeroassist Flight Experiment model in a high enthalpy free piston shock tunnel

This paper describes measurements of heat flux and shock shapes made on a 2.08 percent scale model of the proposed Aeroassist Flight Experiment model in a high enthalpy free piston shock tunnel T3 at the Australian National University in Canberra, Australia. The enthalpy and Reynolds number range covered were 7.5 MJ/kg to 20 MJ/kg and 150,000 to 270,000 per meter respectively. The test Mach number varied between 7.5 and 8. Two test gases, air and nitrogen, were used and the model angle of attack varied from -10 deg to +10 deg to the free stream. The results are discussed and compared to the Mach 10 cold hypersonic air data as obtained in the Langley 31 inch Mach 10 Facility as well as the perfect gas CFD calculations of NASA LaRC.

Gai, S. L.↗

NASA NTRS1992

Flow enthalpy effects on scramjet mixing and combustion

The present analysis of the 3D characteristics of the mixing processes in a scramjet combustor gives attention to the streamwise, vorticity-driven macromixing, as well as shear-driven small-scale mixing, in both an unconfined Mach 6 airstream and a high-enthalpy (Mach-17) confined, Mach 6 airstream. The results obtained indicate that mixing is substantially lower for the high-enthalpy case. The effect of residence time on jet mixing is discussed in view of the production and decay of the axial vorticity, cross-flow velocities, and mean-flow velocities of these confined flows. The effective distance travelled by a fluid particle in the cross-flow, over the combustor length, is used to explain axial vorticity's contribution to mixing.

Riggins, D. W.↗

NASA NTRS1993

Increase in stagnation pressure and enthalpy in shock tunnels

A new technique based on the insertion of a converging section in the driven tube is described which is capable of producing substantial increases in both reservoir pressure and enthalpy. A 1D inviscid full kinetics code is used to study a number of different locations and shapes for the converging driven tube section. For driven tube diameter reductions of factors of 2 and 3, the reservoir pressure is found to increase by factors of 2.1 and 3.2, respectively, and the enthalpy is found to simultaneously increase by factors of 1.5 and 2.1, respectively.

Bogdanoff, David W.↗

NASA NTRS1993

Aerothermodynamic heating due to shock wave/laminar boundary-layer interactions in high-enthalpy hypersonic flow

The interaction between a swept shock wave and a laminar boundary layer was investigated experimentally in high-enthalpy hypersonic flow. The effect of high-temperature, real gas physics on the interaction was examined by conducting tests in air and helium. Heat transfer measurements were made on the surface of a flat plate and a shock-generating fin using thin-film resistance sensors for fin incidence angles of 0, 5, and 10 deg at Mach numbers of 6.9 in air and 7.2 in helium. The experiments were conducted in the NASA HYPULSE expansion tube, an impulse-type facility capable of generating high-enthalpy, high-velocity flow with freestream levels of dissociated species that are particularly low. The measurements indicate that the swept shock wave creates high local heat transfer levels in the interaction region, with the highest heating found in the strongest interaction. The maximum measured heating rates in the interaction are order of magnitude greater than laminar flat plate boundary layer heating levels at the same location.

Hackett, Charles M.↗

NASA NTRS1995

Investigation Flow Uniformity in a Supersonic Duct with High Enthalpy Flows

Flow uniformity in a high enthalpy facility is investigated. The scramjet research facility is composed of a rectangular combustor duct connected to a 100 MW electric arc air heater. The Mach 3.3 flow is accelerated through a two-dimensional contoured nozzle. Instream measurements were made with water-cooled Pitot probes and stagnation point heat flux gages at stream enthalpy levels ranging from 4 to 7 Mj/kg. Flow surveys were made on the flow centerline and off centerline in order to measure the three dimensional uniformity of the flow in the rectangular duct. Measurements indicated that although the flow in the aspect ratio 6:1 duct was relatively uniform on the centerline, three dimensional viscous effects were apparent near the corners. Flow through the nozzle and constant area duct was modeled computationally using a two dimensional, Navier-Stokes, reacting gas code. The computations predict that the flow in the test section is in vibrational equilibrium. The computed and measured Pitot pressure and heat flux profiles are in reasonable agreement with the experimental data.

Balboni, John↗

NASA NTRS2019

Effects of Wall Cooling on Supersonic Modes in High-Enthalpy Hypersonic Boundary Layers over a Cone

High-enthalpy hypersonic boundary-layer transition plays an important role in many entry/descent vehicles. Aerothermodynamic performance of these vehicles strongly depends on the transition location on the surface. However, detailed transition flow physics in these chemically reacting boundary layers are poorly understood and transition estimates during the design phase rely heavily on empirically-derived transition criteria such as 𝑹𝒆(𝜽)/𝑴(𝒆). One of the most intriguing characteristics in hypersonic boundary layers is the presence of unstable supersonic modes, first identified in the 1990s. Due to a recent surge in hypersonic applications, there has been renewed interest in studying the flow physics of supersonic modes using either theory or direct numerical simulations. This paper investigates the rise of supersonic modes in a high-enthalpy hypersonic flow over a 𝟓° half-angle cone at various wall temperatures using both quasiparallel linear stability theory and linear PSE. It was found that supersonic modes exist in all wall temperature conditions including the adiabatic wall case. Cooler wall temperature causes the second Mack mode to become an unstable supersonic mode naturally downstream of the upper-branch neutral location when the wall is sufficiently cooled. In terms of the integrated growth, the second mode is still the dominant mode. Nonetheless, supersonic modes can cause additional series of relatively weaker growth than that of the second mode beyond the peak amplitude location. According to the present linear PSE results, contrary to what was speculated in the literature, supersonic-mode pressure disturbance structure radiated into the freestream is nonacoustic in nature and the formation of unstable supersonic modes is mainly associated with the synchronization of phase speed between the instability and acoustic waves in a nonp ayer, not due to nonlinear modal interaction as suggested in the literature.

Chang, Chau-Lyan↗

DOE OSTI2021

Systems, methods and tools for subterranean electrochemical characterization and enthalpy measurement in geothermal reservoirs

The present disclosure is directed to systems, methods and tools that measure ionic concentrations and downhole enthalpy of a flowing geothermal fluid in real-time at high-temperature and pressure. The systems, methods and tools include measuring the concentration of selected naturally occurring ions found in the liquid phase of the geothermal fluid throughout the wellbore using novel electrochemical sensor technologies. The change in liquid-phase ion concentration will be used to calculate the proportion of liquid to steam and allow for accurate enthalpy measurements. The techniques and technologies described here can be applied to any application of electrochemical sensing in extreme environments.

Cieslewski, Grzegorz↗