H2S and HS- Adsorption on a Charged Cu Surface in an Electrolyte: Effect of Ionic Strength

1997 ◽  
Vol 492 ◽  
Author(s):  
W. D. Wilson ◽  
C. M. Schaldach
Keyword(s):  
Ionic Strength ◽  
The United States ◽  
Binding Energies ◽  
Department Of Energy ◽  
Molecular Surface ◽  
Double Layers ◽  
Real Surface ◽  
United States Department ◽  
Surface Charges ◽  
Hartree Fock

ABSTRACTWe present a method for the calculation of the binding and rotational energies of neutral (H2S) and charged (HS-) molecules impinging upon a charged (Cu <100>) surface in the presence of an electrolyte. A molecular surface is constructed surrounding the H2S and HS- molecules forming boundary elements. A coupled Schrödinger-Poisson-Boltzmann iterative procedure treats the electronic structure of the molecules at the 6–31G**/MP2 level of theory and includes solvation effects through the single and double layers of charge induced by the electronic distribution. The molecule, together with its charged layers, forms a Molecular Single and Double Layer (MSDL), an object which then interacts with a Gouy-Chapman plane within the electrolyte. The additional induced charge at the molecular surface resulting from this electric field is obtained by solving a second set of boundary element equations. Repulsive interactions between the atoms of the molecule and those of the surface are obtained using a rigid-ion Hartree-Fock method. Binding energies of the molecule to the surface are determined as a function of the real surface charge imposed and also the ionic strength of the solution. It is found that surface charges can completely (180°) reorient these molecules and that the counterions in the solution can completely screen binding effects of even large surface charges.Work supported by the United States Department of Energy under contract #DE-AC04–94AL85000.

An Overview of the Direct Energy Conversion Proof of Principle Power Production Program

2004 ◽  
Author(s):  
D. King ◽  
G. Rochau ◽  
D. Oscar ◽  
C. Morrow ◽  
P. Tsvetkov ◽  
...  
Keyword(s):  
Energy Conversion ◽  
The United States ◽  
Department Of Energy ◽  
Future Research ◽  
United States Department ◽  
Commercial Development ◽  
Direct Energy Conversion ◽  
Project Description ◽  
Direct Energy ◽  
Proof Of Principle

The United States Department of Energy, Nuclear Energy Research Initiative (NERI) Direct Energy Conversion Proof of Principle (DECPOP) project has as its goal the development of a direct energy conversion process suitable for commercial development. We define direct energy conversion as any fission process that returns usable energy without an intermediate thermal process. A prior Direct Energy Conversion (DEC) project [1] has been completed and indicates that a viable direct energy device is possible if several technological issues can be overcome. The DECPOP program is focusing on two of the issues: charged particle steering and high voltage hold-off. This paper reports on the progress of the DECPOP project. Two prototype concepts are under development: a Fission Electric Cell using magnetic insulation and a Fission Fragment Magnetic Collimator using magnetic fields to direct fission fragments to collectors. Included in this paper are a short project description, an abbreviated summary of the work completed to date, a description of ongoing and future project activities, and a discussion of the potential for future research and development.

Investigation of the Down-Scaling Effects on the Low Swirl Burner and its Application to Microturbines

2018 ◽  
Author(s):  
Alex Frank ◽  
Peter Therkelsen ◽  
Miguel Sierra Aznar ◽  
Vi H. Rapp ◽  
Robert K. Cheng ◽  
...  
Keyword(s):  
Power Systems ◽  
Power Plants ◽  
Energy Savings ◽  
The United States ◽  
Primary Energy ◽  
Department Of Energy ◽  
Small Scale ◽  
United States Department ◽  
Scaling Effects ◽  
Swirl Burner

About 75% of the electric power generated by centralized power plants feeds the energy needs from the residential and commercial sectors. These power plants waste about 67% of primary energy as heat emitting 2 billion tons of CO2 per year in the process (∼ 38% of total US CO2 generated per year) [1]. A study conducted by the United States Department of Energy indicated that developing small-scale combined heat and power systems to serve the commercial and residential sectors could have a significant impact on both energy savings and CO2 emissions. However, systems of this scale historically suffer from low efficiencies for a variety of reasons. From a combustion perspective, at these small scales, few systems can achieve the balance between low emissions and high efficiencies due in part to the increasing sensitivity of the system to hydrodynamic and heat transfer effects. Addressing the hydrodynamic impact, the effects of downscaling on the flowfield evolution were studied on the low swirl burner (LSB) to understand if it could be adapted to systems at smaller scales. Utilizing particle image velocimetry (PIV), three different swirlers were studied ranging from 12 mm to 25.4 mm representing an output range of less than 1 kW to over 23 kW. Results have shown that the small-scale burners tested exhibited similar flowfield characteristics to their larger-scale counterparts in the non-reacting cases studied. Utilizing this data, as a proof of concept, a 14 mm diameter LSB with an output of 3.33 kW was developed for use in microturbine operating on a recuperated Brayton cycle. Emissions results from this burner proved the feasibility of the system at sufficiently lean mixtures. Furthermore, integration of the newly developed LSB into a can style combustor for a microturbine application was successfully completed and comfortably meet the stringent emissions targets. While the analysis of the non-reacting cases was successful, the reacting cases were less conclusive and further investigation is required to gain an understanding of the flowfield evolution which is the subject of future work.

Application of SPSLIFE to Preliminary Design Evaluation and Life Assessment of CSGT Components

1995 ◽  
Vol 117 (3) ◽  
pp. 424-431
Author(s):  
A. Saith ◽  
P. F. Norton ◽  
V. M. Parthasarathy
Keyword(s):  
Gas Turbines ◽  
Computer Code ◽  
The United States ◽  
Department Of Energy ◽  
Life Assessment ◽  
Design Evaluation ◽  
United States Department ◽  
Preliminary Design ◽  
Detail Design ◽  
Stage 1

The Ceramic Stationary Gas Turbine (CSGT) Program has utilized the SPSLIFE computer code to evaluate the preliminary design of ceramic components. The CSGT program is being performed under the sponsorship of the United States Department of Energy, Office of Industrial Technology, to improve the performance of stationary gas turbines in cogeneration through the selective replacement of hot section components with ceramic parts. Preliminary design evaluation and life assessment results are presented here for the following components: (1) Stage 1 turbine blade, (2) Stage 1 turbine nozzle, and (3) combustor inner liner. From the results of the analysis, recommendations are made for improving the life and reliability of the components. All designs were developed in Phase I (preliminary design) of the CSGT program and will be optimized in Phase II (detail design) of the program.

The AGT101 Advanced Automotive Gas Turbine

1982 ◽  
Author(s):  
R. A. Rackley ◽  
J. R. Kidwell
Keyword(s):  
United States ◽  
Gas Turbine ◽  
The United States ◽  
Gas Turbine Engine ◽  
Development Project ◽  
Single Stage ◽  
Department Of Energy ◽  
Inlet Temperature ◽  
United States Department ◽  
Turbine Engine

The Garrett/Ford Advanced Gas Turbine Powertrain System Development Project, authorized under NASA Contract DEN3-167, is sponsored by and is part of the United States Department of Energy Gas Turbine Highway Vehicle System Program. Program effort is oriented at providing the United States automotive industry the technology base necessary to produce gas turbine powertrains competitive for automotive applications having: (1) reduced fuel consumption, (2) multi-fuel capability, and (3) low emissions. The AGT101 powertrain is a 74.6 kW (100 hp), regenerated single-shaft gas turbine engine operating at a maximum turbine inlet temperature of 1644 K (2500 °F), coupled to a split differential gearbox and Ford automatic overdrive production transmission. The gas turbine engine has a single-stage centrifugal compressor and a single-stage radial inflow turbine mounted on a common shaft. Maximum rotor speed is 10,472 rad/sec (100,000 rpm). All high-temperature components, including the turbine rotor, are ceramic. AGT101 powertrain development has been initiated, with testing completed on many aerothermodynamic components in dedicated test rigs and start of Mod I, Build 1 engine testing.

Application of Spslife to Preliminary Design Evaluation and Life Assessment of CSGT Components

1994 ◽  
Author(s):  
Arun Saith ◽  
Paul F. Norton ◽  
Vijay M. Parthasarathy
Keyword(s):  
Gas Turbines ◽  
Computer Code ◽  
The United States ◽  
Department Of Energy ◽  
Life Assessment ◽  
Design Evaluation ◽  
United States Department ◽  
Preliminary Design ◽  
Detail Design ◽  
Stage 1

The Ceramic Stationary Gas Turbine (CSGT) Program has utilized the SPSLIFE computer code to evaluate the preliminary design of ceramic components. The CSGT program is being performed under the sponsorship of the United States Department of Energy, Office of Industrial Technology, to improve the performance of stationary gas turbines in cogeneration through the selective replacement of hot section components with ceramic parts. Preliminary design evaluation and life assessment results are presented here for the following components: (1) Stage 1 Turbine Blade, (2) Stage 1 Turbine Nozzle, and (3) Combustor Inner Liner. From the results of the analysis, recommendations are made for improving the life and reliability of the components. All designs were developed in Phase I (preliminary design) of the CSGT program and will be optimized in Phase II (detail design) of the program.

An Overview of the Direct Energy Conversion Power Production Program

2002 ◽  
Author(s):  
G. Rochau ◽  
J. Cash ◽  
D. King ◽  
C. Morrow ◽  
D. Seidel ◽  
...  
Keyword(s):  
Energy Conversion ◽  
The United States ◽  
Department Of Energy ◽  
Future Research ◽  
United States Department ◽  
Commercial Development ◽  
Production Program ◽  
Direct Energy Conversion ◽  
Project Description ◽  
Direct Energy

The United States Department of Energy, Nuclear Energy Research Initiative (NERI) Direct Energy Conversion (DEC) project has as its goal the development of a direct energy conversion process suitable for commercial development. We define direct energy conversion as any fission process that returns usable energy without an intermediate thermal process. Enough of the project has been completed, roughly two thirds, to indicate that a viable direct energy device is possible. This paper reports on the progress of the DEC project. Three concepts are under development: Fission Electric Cell using magnetic insulation, Magnetic Collimator using magnetic fields to direct fission fragments to collectors, and Gas Vapor Core Reactor using magnetohydrodynamics to generate electrical current. Included in this paper area a short project description, an abbreviated summary of the work completed to date, a description of ongoing and future project activities, and a discussion of the potential for future research and development.

Performance Goal-Based Seismic Design Standards for Critical Facilities in the United States

2003 ◽  
Author(s):  
Quazi A. Hossain
Keyword(s):  
United States ◽  
Seismic Design ◽  
Functional Performance ◽  
Design Method ◽  
The United States ◽  
Department Of Energy ◽  
Performance Goals ◽  
United States Department ◽  
Active Member ◽  
Performance Goal

For more than the last fifteen years, the United States Department of Energy (DOE) has been using a probabilistic performance goal-based seismic design method for structures, systems, and components (SSCs) in its nuclear and hazardous facilities. Using a graded approach, the method permits the selection of probabilistic performance goals or acceptable failure rates for SSCs based on the severity level of SSC failure consequences. The method uses a site-specific probabilistic seismic hazard curve as the basic seismic input motion definition, but utilizes the existing national industry consensus design codes for specifying load combination and design acceptance criteria in such a way that the target probabilistic performance goals are met. Recently, the American Nuclear Society (ANS) and the American Society of Civil Engineers (ASCE) have undertaken the development of a number of national consensus standards that will utilize the performance goal-based seismic design experience base in the DOE complex. These standards are presently in various stages of development, some nearing completion. Once completed, these standards are likely to be adopted by various agencies and organizations in the United States. In addition to the graded approach of DOE’s method, these standards incorporate design provisions that permit seismic design of SSCs to several levels of functional performance. This flexibility of choosing a functional performance level in the design process results in an optimum, but risk-consistent design. The paper will provide an outline of two of these standards-in-progress and will present the author’s understanding of their basic philosophies and technical bases. Even though the author is an active member of the development committees for these two standards, the technical opinions expressed in this paper are author’s own, and does not reflect the views of any of the committees or the views of the organizations with which any member of the committees are affiliated.

Modeling Shock and Vibration on Used Nuclear Fuel During Normal Conditions of Transportation

2019 ◽  
Author(s):  
Nicholas Klymyshyn ◽  
Pavlo Ivanusa ◽  
Kevin Kadooka ◽  
Casey Spitz
Keyword(s):  
Nuclear Fuel ◽  
Numerical Models ◽  
National Laboratory ◽  
Pacific Northwest National Laboratory ◽  
The United States ◽  
Lessons Learned ◽  
Department Of Energy ◽  
United States Department ◽  
Fuel Cladding ◽  
Used Nuclear Fuel

Abstract In 2017, the United States Department of Energy (DOE) collaborated with Spanish and Korean organizations to perform a multimodal transportation test to measure shock and vibration loads imparted to used nuclear fuel (UNF) assemblies. This test used real fuel assembly components containing surrogate fuel mass to approximate the response characteristics of real, irradiated used nuclear fuel. Pacific Northwest National Laboratory was part of the test team and used the data collected during this test to validate numerical models needed to predict the response of real used nuclear fuel in other transportation configurations. This paper summarizes the modeling work and identifies lessons learned related to the modeling and analysis methodology. The modeling includes railcar dynamics using the NUCARS software code and explicit dynamic finite element modeling of used nuclear fuel cladding in LS-DYNA. The NUCARS models were validated against railcar dynamics data collected during captive track testing at the Federal Railroad Administration’s Transportation Technology Center in Pueblo, CO. The LS-DYNA models of the fuel cladding were validated against strain gage data collected throughout the test campaign. One of the key results of this work was an assessment of fuel cladding fatigue, and the methods used to calculate fatigue are detailed in this paper. The validated models and analysis methodologies described in this paper will be applied to evaluate future UNF transportation systems.

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