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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 379 records · Page 21
All sourcesNASA NTRSDOE OSTI
NASA NTRS2012

Dynamic Modeling of Process Technologies for Closed-Loop Water Recovery Systems

Detailed chemical process simulations are a useful tool in designing and optimizing complex systems and architectures for human life support. Dynamic and steady-state models of these systems help contrast the interactions of various operating parameters and hardware designs, which become extremely useful in trade-study analyses. NASA s Exploration Life Support technology development project recently made use of such models to compliment a series of tests on different waste water distillation systems. This paper presents dynamic simulations of chemical process for primary processor technologies including: the Cascade Distillation System (CDS), the Vapor Compression Distillation (VCD) system, the Wiped-Film Rotating Disk (WFRD), and post-distillation water polishing processes such as the Volatiles Removal Assembly (VRA). These dynamic models were developed using the Aspen Custom Modeler (Registered TradeMark) and Aspen Plus(Registered TradeMark) process simulation tools. The results expand upon previous work for water recovery technology models and emphasize dynamic process modeling and results. The paper discusses system design, modeling details, and model results for each technology and presents some comparisons between the model results and available test data. Following these initial comparisons, some general conclusions and forward work are discussed.

Allada, Rama Kumar↗
DOE OSTI2016

High efficiency process and high protein feed co-product

A process is disclosed for producing a feed co-product by ethanol fermentation of plant matter comprising starch and another polysaccharide selected from the group consisting of hemicellulose and cellulose. The process comprises: (i) carrying out a primary fermentation process, distilling the primary fermentation mixture to form a primary feed co-product derived from the fermentation of the primary fermentation mixture and a primary distillate product comprising ethanol and (ii) carrying out a secondary fermentation process and distilling the secondary fermentation mixture to form the modified feed co-product and a secondary distillate product comprising ethanol.

Mielgo, Iaki↗
DOE OSTI2015

Thermal coupling links to liquid-only transfer streams: An enumeration method for new FTC dividing wall columns

Novel dividing wall columns (DWCs) can be obtained by converting thermal couplings to liquid-only transfer streams. We develop a simple four-step method to generate a complete set of DWCs containing n - 2 dividing walls, for a given n-component fully thermally coupled (FTC) distillation. Among the novel DWCs, some easy-to-operate DWCs possess the property that the vapor flow in every section of the DWC can be controlled during operation by means that are external to the column. We develop a simple method to enumerate all such easy-to-operate DWCs. We expect that the easy-to-operate DWCs can be operated close-to-optimality; leading to a successful industrial implementation of the n-component (n ≥ 3) FTC distillation in the form of a DWC. As an illustration, we show figures of all easy-to-operate DWCs with two dividing walls for the four-component FTC distillation.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2026

Evaluation of methods and improvement of predictions for specification properties of petroleum-based and alternative aviation fuels

To support our research and process modeling for liquid fuels, including blends, from petroleum and synthetic sources such as from biomass intermediates, we evaluated composition-based prediction methods and improved predictions for five key specification properties of petroleum-based and alternative aviation fuels, namely distillation temperatures (10 % distilled, t 10 , and final boiling point, t FBP ), density, flash point, net heat of combustion, and freezing point. The types of fuels included were petroleum-based jet fuels, jet-fuel surrogate mixtures, synthetic blending components obtained from different sources, and blends of Jet A with many synthetic blending components. Expanded datasets to update associated parameters allowed significant improvements for one of the prediction methods used in earlier work, namely the Modified Weighted Average method published initially by Shi et al. By considering the importance of lighter compounds for flash points and heavier compounds for freezing points, the revised Modified Weighted Average method was further improved. For liquid density, the revised Modified Weighted Average method gave the best overall results. The revised Modified Weighted Average method, the American Society for Testing and Materials D7215 method, and the D7215 method modified by another group gave comparable results for flash point, while the revised Modified Weighted Average and D3338 methods gave the best results for net heat of combustion. Freezing point was well predicted using the revised Modified Weighted Average method and showed the most significant improvements over current predictions. Distillation temperature t 10 was not well predicted, while t FBP was predicted with a mean absolute error comparable to experimental reproducibility.

09 BIOMASS FUELS↗
DOE OSTI2024

An Explainable Classification Framework for Determining and Understanding the Suitability of Solvent Extraction for Bioproduct Recovery

Lignocellulosic biomass is an abundant feedstock for producing sustainable fuels and chemicals. However, a key challenge in most biomass utilization strategies is the recovery of products from a dilute, typically aqueous, phase. In this respect, liquid–liquid extraction, which relies on a solvent to transfer a product of interest from one liquid phase to another (solvent-rich) phase, is a technology that can reduce the energy requirements for product recovery. To reduce solvent consumption, liquid–liquid extraction needs to be combined with another separation method (e.g., distillation) to recycle the solvent. Despite the research on solvent extraction, there are limited system-wide methods that allow us to determine when extraction is well suited to carry out a specific separation. Accordingly, we present a classification framework to predict whether extraction, coupled with distillation, is feasible and more economical than distillation. Our framework is based on features such as feed composition, liquid–liquid equilibrium constants, relative volatilities, and solvent price, and leads to trained classifiers that show good prediction accuracy. We further study how specific features influence the suitability of extraction. Furthermore, to showcase the applicability of the framework, we use it to analyze the separation of acetic acid from water.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2018

Isolation and Purification of Monofunctional Methoxyphenols from Loblolly Pine Biocrude

Methoxyphenols (MPs) are valuable chemicals in liquid intermediates from pyrolysis of lignocellulosic biomass. The use of a single technique to recover a high-purity bioproduct of MPs from pyrolysis liquid is challenging. The purpose of this study is to combine distillation and chromatography techniques in sequence to recover exclusively eugenols and guaiacols as monofunctional MPs in biocrude produced from pyrolysis of loblolly pine with a nonzeolite alumina catalyst. A biocrude containing 11.0 wt% of the targeted monofunctional MPs was first distilled in two stages to recover an MP-rich fraction with 49.3 wt% concentration of MPs at a recovery efficiency of 86.9%. A flash chromatography separation using silica gel adsorbent was then used to purify the MP-enriched distillate. A final MP bioproduct with average purity of 87.3-93.1 wt% was achieved. Here, the average efficiency of the chromatography separation step varied between 73.9-82.5% depending on the silica particle size used.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2015

Improved Method for the Production of Tetrahydrofuran From Biomass

Statement of the Problem: Tetrahydrofuran (THF) is a large volume, commodity chemical used as a basic building block for polyurethane stretch fibers (Spandex), other elastomers, solvents for PVC cements, pharmaceuticals, and coatings. Current THF production requires petroleum-based raw materials and significant energy inputs, representing inefficient use of petroleum resources and placing the U.S. at a manufacturing disadvantage compared to chemical manufacturers in other world areas. Pulp and paper manufacture is one of the largest industries in the U.S., representing about 6% of the manufacturing sector of the U.S. GDP. In recent decades, the pulp and paper industry has struggled with a declining market, poor profitability, and competition from other world areas, leading to the shutdown of many U.S. pulp and paper mills, and loss of U.S. employment. The production of chemicals, such as THF from pulp and paper waste hydrolysate, can provide new technologies and products from pulp and paper manufacture which can enhance industry profitability. The iCARD technology will produce and sell THF from selected pulp and paper byproduct hydrolysates without deleterious effect on ongoing pulp production of the mill. Overall Objective: The overall goal of this Small Business Innovation Research Phase II Project was to complete the research, development, and design tasks required to commercialize an innovative technology using catalytic reactive distillation to achieve process intensification for the manufacture of “green” THF from pulp mill waste hydrolysate. The new technology will benefit the U.S. pulp and paper industry by providing new technologies and products from pulp and paper manufacture, which can enhance industry profitability, and increase industry employment. Development of commercially competitive biomass based technologies will reduce consumption of scarce hydrocarbon resources, and improve long term U.S. competitiveness in global markets. Conclusions: The novel catalytic reactive distillation technology successfully demonstrated the technical and economic feasibility of the manufacture of THF production from dilute aqueous biomass solutions. New catalyst compositions were developed with catalytic activity for conversion of furfural to THF which exceed the activity of conventional catalysts by 2 to 3 orders of magnitude. The feasibility of achieving selectivity to the desired THF product approaching 100% was demonstrated. The novel catalysts also demonstrated catalyst stability far superior to conventional furfural decarbonylation catalysts. The novel technology also demonstrated the ability to produce other valuable commercial products such as tetrahydrofurfuryl alcohol, 1,5-pentanediol, 2-methyl furan, and 2-tetrahydromethylfuran as co-products with THF. Based on the use of waste pulp mill hydrolysate as the biomass raw material source, the new technology will produce THF for a total manufacturing cost less than the raw material cost for the hydrocarbon-based feed stocks for conventional THF production. Commercial Applications: Selective catalytic reactive distillation of pulp mill waste hydrolysate will allow commercial production of “green” THF from biomass feedstocks for the production of “green” elastomer fibers, and industrial solvents. The new technology will benefit the U.S. pulp and paper industry by providing new technologies and products from pulp and paper manufacture, which can enhance industry profitability, and increase industry employment. Development of commercially competitive biomass based technologies will reduce consumption of scarce hydrocarbon resources, and improve long term U.S. competitiveness in global markets.

09 BIOMASS FUELS↗
DOE OSTI2016

Manufacture of Acrylic Acid from Biomass Derived Intermediates

Statement of Problem Acrylic acid is a global commodity chemical used in acrylic paints, coatings, adhesives, detergents, and hygienic products. The current method to manufacture acrylic acid is a complex, energy intensive process, based on hydrocarbon feedstocks. This proposal will provide a novel selective catalytic reactive distillation technology for the manufacture of acrylic acid from biomass. This proposal will provide technology for producing acrylic acid from crude glycerol, a byproduct of biodiesel manufacture. Crude glycerol is currently in substantial over-supply in the market place, is economically burdensome to biodiesel producers, and is available at extremely low cost. The acrylic acid product of this proposed program is identical to that now derived from petroleum sources, and is a direct substitute in the market. The Solution The overall goal of this Small Business Innovation Research project is to commercialize an innovative, integrated catalytic reactive distillation/oxidation technology to convert crude glycerol into acrylic acid, for use in paints, coatings and adhesives. The Phase I project established the technical and economic feasibility of the innovative technology, based on novel catalyst compositions, to manufacture acrylic acid from the crude glycerol byproduct resulting from biodiesel manufacture. Application of the proposed technology will achieve a biobased route to acrylic acid manufacture, while offsetting biodiesel production costs by increasing the value of the crude glycerol byproduct credits, by (1) the use of process intensification techniques, specifically catalytic reactive distillation, to remove acrolein as it is generated by the reaction, thereby suppressing degradation reactions; (2) the development of novel catalysts, specifically designed for use in a catalytic reactive distillation environment, for the dehydration of glycerol with very high selectivity; and (3) the demonstration of the catalytic oxidation of the acrolein to acrylic acid at exceptionally high yield. Commercial Applications and Other Benefits: The use of the integrated catalytic reactive distillation/oxidation technology should find immediate application for the production of acrylic acid from inexpensive crude glycerol byproduct of biodiesel production, thereby supporting the growth of biorefineries, and improving long term U.S. employment and competitiveness in global markets. The novel technology is potentially applicable to production of other products from renewable biomass based resources.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2018

Fouling-Resistant Membranes for Treating Concentrated Brines for Water Reuse in Advanced Energy Systems- Final Technical Report

The high total dissolved solids (TDS) levels in the wastewater quality generated from unconventional oil and gas development make the current state-of-the art approach to water treatment/disposal untenable. Our proposed membrane technology approach addresses the two major challenges associated with this water: 1) the membrane distillation process removes the high TDS content, which is often 8 times higher than that of seawater, and 2) our novel membrane coating prevents the formation of scale that would otherwise pose a significant operational hurdle. This is accomplished through next-generation electrically conductive membranes that mitigate fouling beyond what is currently possible, and allow for the flexibility to treat to the water to levels desirable for multiple reuse options, thus reducing fresh water withdrawal, all the way to direct disposal into the environment. The overall project objective was to demonstrate the efficacy of membrane distillation (MD) as a cost-savings technology to treat concentrated brines (such as, but not limited to, produced waters generated from fossil fuel extraction) that have high levels of TDS for beneficial water reuse in power production and other industrial operations as well as agricultural and municipal water uses. In addition, a novel fouling-resistant nanocomposite membrane was developed to reduce the need for chemicals to address membrane scaling due to the precipitation of divalent ions in high-TDS waters and improve overall MD performance via an electrically conductive membrane distillation process (ECMD). This anti-fouling membrane technology platform is based on incorporating carbon nanotubes (CNTs) into the surface layer of existing, commercially available MD membranes. The CNTs impart electrical conductivity to the membrane surface to prevent membrane scaling and fouling when an electrical potential is applied.

36 MATERIALS SCIENCE↗
DOE OSTI2016

Investigations for the Recycle of Pyroprocessed Uranium

Given the renewed interest in uranium from the pyroprocessing of used nuclear fuel in a molten salt system, the two biggest hurdles for marketing the uranium are radiation levels and transuranic content. A radiation level as low as possible is desired so that handling operations can be performed directly with the uranium. The transuranic content of the uranium will affect the subsequent waste streams generated and, thus also should be minimized. Although the pyroprocessing technology was originally developed without regard to radiation and transuranic levels, adaptations to the process have been considered to market the uranium. Process conditions have been varied during the distillation and casting cycles of the process with increasing temperature showing the largest effect on the reduction of radiation levels. Transuranic levels have been reduced significantly by incorporating a pre-step in the salt distillation operation to remove a majority of the salt prior to distillation.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2016

Hybrid Ultra‐Microporous Materials for Selective Xenon Adsorption and Separation

Abstract The demand for Xe/Kr separation continues to grow due to the industrial significance of high‐purity Xe gas. Current separation processes rely on energy intensive cryogenic distillation. Therefore, less energy intensive alternatives, such as physisorptive separation, using porous materials, are required. Herein we show that an underexplored class of porous materials called hybrid ultra‐microporous materials (HUMs) affords new benchmark selectivity for Xe separation from Xe/Kr mixtures. The isostructural materials, CROFOUR‐1‐Ni and CROFOUR‐2‐Ni, are coordination networks that have coordinatively saturated metal centers and two distinct types of micropores, one of which is lined by CrO 4 2− (CROFOUR) anions and the other is decorated by the functionalized organic linker. These nets offer unprecedented selectivity towards Xe. Modelling indicates that the selectivity of these nets is tailored by synergy between the pore size and the strong electrostatics afforded by the CrO 4 2− anions.

Mohamed, Mona H.↗
DOE OSTI2017

Xenon Recovery at Room Temperature using Metal-Organic Frameworks

Xenon is known to be a very efficient anesthetic gas but its cost prohibits the wider use in medical industry and other potential applications. It has been shown that Xe recovery and recycle from anesthetic gas mixture can significantly reduce its cost as anesthetic. The current technology uses series of adsorbent columns followed by low temperature distillation to recover Xe, which is expensive to use in medical facilities. Herein, we propose much efficient and simpler system to recover and recycle Xe from simulant exhale anesthetic gas mixture at room temperature using metal organic frameworks. Among the MOFs tested, PCN-12 exhibits unprecedented performance with high Xe capacity, Xe/N2 and Xe/O2 selectivity at room temperature. The in-situ synchrotron measurements suggest the Xe is occupied in the small pockets of PCN-12 compared to unsaturated metal centers (UMCs). Computational modeling of adsorption further supports our experimental observation of Xe binding sites in PCN-12.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2019

Bound and mobile soil water isotope ratios are affected by soil texture and mineralogy, whereas extraction method influences their measurement

Questions persist about interpreting isotope ratios of bound and mobile soil water pools, particularly relative to clay content and extraction conditions. Interactions between pools and resulting extracted water isotope composition are presumably related to soil texture, yet few studies have manipulated the bound pool to understand its influence on soil water processes. Using a series of drying and spiking experiments, we effectively labelled bound and mobile water pools in soils with varying clay content. Soils were first vacuum dried to remove residual water, which was then replaced with heavy isotope-enriched water prior to oven drying and spiking with heavy isotope-depleted water. Water was extracted via centrifugation or cryogenic vacuum distillation (at four temperatures) and analysed for oxygen and hydrogen isotope ratios via isotope ratio mass spectrometry. Water from centrifuged samples fell along a mixing line between the two added waters but was more enriched in heavy isotopes than the depleted label, demonstrating that despite oven drying, a residual pool remains and mixes with the mobile water. Soils with higher clay + silt content appeared to have a larger bound pool. Water from vacuum distillation samples have a significant temperature effect, with high temperature extractions yielding progressively more heavy isotope-enriched values, suggesting that Rayleigh fractionation occurred at low temperatures in the vacuum line. By distinctly labelling bound and mobile soil water pools, we detected interactions between the two that were dependent on soil texture. Although neither extraction method appeared to completely extract the combined bound and mobile (total water) pool, centrifugation and high temperature cryogenic vacuum distillations were comparable for both δ 2 H and δ 18 O of soil water isotope ratios.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2016

Nonlocal hyperconcentration on entangled photons using photonic module system

Entanglement distribution will inevitably be affected by the channel and environment noise. Thus distillation of maximal entanglement nonlocally becomes a crucial goal in quantum information. Here we illustrate that maximal hyperentanglement on nonlocal photons could be distilled using the photonic module and cavity quantum electrodynamics, where the photons are simultaneously entangled in polarization and spatial-mode degrees of freedom. The construction of the photonic module in a photonic band-gap structure is presented, and the operation of the module is utilized to implement the photonic nondestructive parity checks on the two degrees of freedom. We first propose a hyperconcentration protocol using two identical partially hyperentangled initial states with unknown coefficients to distill a maximally hyperentangled state probabilistically, and further propose a protocol by the assistance of an ancillary single photon prepared according to the known coefficients of the initial state. In the two protocols, the total success probability can be improved greatly by introducing the iteration mechanism, and only one of the remote parties is required to perform the parity checks in each round of iteration. Estimates on the system requirements and recent experimental results indicate that our proposal is realizable with existing or near-further technologies.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2024

Experimental investigation of the small-scale prototype of the dew point water recovery system

The article presents experimental investigation of the Dew Point Water Recovery (DPWR) system designed for clean water recovery using the dew point cooling phenomenon. The technology is a novel distillation process which allows for highly efficient water recovery. It is a first distillation technology which allows for water distillation through direct contact with atmospheric air. The authors designed, built, and tested an original prototype of a laboratory-scale DPWR system to verify its basic operating principles and perform performance analysis. It was shown that on average 10 × 10 −6 m 3 of clean water could be recovered from each cubic meter of the supply air with an average GOR of 1.9. Although the operation of the DPWR system requires electricity to drive fans, pumps and other associated equipment, the actual driving force of the system is thermal energy. The average thermal energy demand of the DPWR system was 370 kWh/m 3 , and more than half of this energy was based on the thermodynamic potential of the supply air. Based on experimental data, the mathematical model of the DPWR system was verified and it was found that the average relative discrepancy in predicting air temperature did not exceed 8%, and in predicting air humidity: 5%. In conclusion, the conducted experiments confirmed that the proposed DPWR system is feasible and has the potential to fill the technological gap in terms of a low-energy and easily accessible water recovery method.

42 ENGINEERING↗
DOE OSTI2026

Modeling and analysis of synthetic liquid fuel production from CO 2 and nuclear energy using methanol-to-diesel process

Electrofuels (e-fuels) are synthetic fuels produced from carbon dioxide (CO 2 ) and electricity for blending with or replacing petroleum fuels. Nuclear energy is an attractive energy feedstock for e-fuel production because of its low environmental footprint and its ability to provide steady heat and power essential for e-fuels production. We modeled and evaluated the cost and environmental footprint of e-fuels production in the distillate range for three nuclear power scales, 100, 500, and 1000 MWe, through methanol and olefins intermediates leveraging commercial or high technology readiness level (TRL) processes. Compared to the commonly studied e-fuels from Fischer Tropsch process that has a distillate yield of <70% with the rest being low value naphtha, the proposed process via methanol intermediate increases the product selectivity with distillate yield of 96% and only 4% naphtha. The modeled process has a carbon conversion ratio of 98%, and a process energy efficiency of 56% relative to the total equivalent nuclear electricity input. The e-fuel plant economics and GHG emissions were estimated by considering CO 2 collected from ethanol plants adjacent to nuclear power plants. The estimated minimum fuel selling prices (MFSP) of e-fuel is in the range of $5.7-$9.1/gal depending on e-fuel plant scale, electricity cost, and CO 2 transportation distance. The corresponding e-fuels life cycle GHG emissions is estimated in the range of 5-6 gCO 2 e/MJ of liquid fuel using the R&D Greenhouse gases, Regulated Emissions, and Energy use in Technologies (R&D GREET) model.

10 SYNTHETIC FUELS↗