Engineering topics

Kim, H. D.

Publications and source records attributed to Kim, H. D..

5 records

DOE OSTI2018

Mechanism of Benzene Tribopolymerization on the RuO 2 (110) Surface

A tribopolymer formed on the contacts of microelectromechanical and nanoelectromechanical system (MEMS-NEMS) devices is a major concern hampering their practical use in information technology. Conductive metal oxides, such asRuO 2 and RuO 3 , have been regarded as promising candidate materials for MEMS-NEMS contacts due to their conductivity, hardness, and relatively chemically inert surfaces. However, recent experimental works demonstrate that trace amounts of a polymer could still form on RuO 2 surfaces. We demonstrate the mechanism of this class of unexpected tribopolymer formation by conducting density-functional-theory-based computational compression experiments with benzene as the contamination gas. First, mechanical force during compression changes the benzene molecules from slightly physisorbed to strongly chemisorbed. Further compression causes deformation and chemical linkage of the benzene molecules. Finally, the two contacts detach, with one having a complex organic molecule attached and the other a more reactive surface. The complex organic molecule, which has an oxabicyclic segment, can be viewed as the rudiment of a tribopolymer, and the more reactive surface can trigger the next adsorption-reaction-tribopolymer formation cycle. Based on these results, we also predict tribopolymer formation rates by using transition-state theory and the second-order rate law. We promote a deeper understanding of tribopolymer formation (especially on metal oxides) and provide strategies for suppressing tribopolymerization.

36 MATERIALS SCIENCE↗

DOE OSTI2013

3S (Safeguards, Security, Safety) based pyroprocessing facility safety evaluation plan

The big advantage of pyroprocessing for the management of spent fuels against the conventional reprocessing technologies lies in its proliferation resistance since the pure plutonium cannot be separated from the spent fuel. The extracted materials can be directly used as metal fuel in a fast reactor, and pyroprocessing reduces drastically the volume and heat load of the spent fuel. KAERI has implemented the SBD (Safeguards-By-Design) concept in nuclear fuel cycle facilities. The goal of SBD is to integrate international safeguards into the entire facility design process since the very beginning of the design phase. This paper presents a safety evaluation plan using a conceptual design of a reference pyroprocessing facility, in which 3S (Safeguards, Security, Safety)-By-Design (3SBD) concept is integrated from early conceptual design phase. The purpose of this paper is to establish an advanced pyroprocessing hot cell facility design concept based on 3SBD for the successful realization of pyroprocessing technology with enhanced safety and proliferation resistance.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

DOE OSTI2012

Sintered-reaction Bonded Silicon Nitride Densified by a Gas Pressure Sintering Process Effects of Rare Earth Oxide Sintering Additives

Reaction-bonded silicon nitrides containing rare-earth oxide sintering additives were densified by gas pressure sintering. The sintering behavior, microstructure and mechanical properties of the resultant specimens were analyzed. For that purpose, Lu2O3-SiO2 (US), La2O3-MgO (AM) and Y2O3-Al2O3 (YA) additive systems were selected. Among the tested compositions, densification of silicon nitride occurred at the lowest temperature when using the La2O3-MgO system. Since the Lu2O3-SiO2 system has the highest melting temperature, full densification could not be achieved after sintering at 1950oC. However, the system had a reasonably high bending strength of 527 MPa at 1200oC in air and a high fracture toughness of 9.2 MPa m1/2. The Y2O3-Al2O3 system had the highest room temperature bending strength of 1.2 GPa

36 MATERIALS SCIENCE↗

NASA NTRS2001

Wind Code Application to External Forebody Flowfields with Comparisons to Experimental Results

The WIND Code, a general purpose Navier-Stokes solver, has been utilized to obtain supersonic external flowfield Computational Fluid Dynamics (CFD) solutions over an axisymmetric, parabolic forebody with comparisons made to wind tunnel experimental results. Various cases have been investigated at supersonic freestream conditions ranging from Mach 2.0 to 3.5, at 0 deg and 3 deg angles-of-attack, and with either a sharp-nose or blunt-nose forebody configuration. Both a turbulent (Baldwin-Lomax algebraic turbulence model) and a laminar model have been implemented in the CFD. Obtaining the solutions involved utilizing either the parabolized- or full-Navier-Stokes analyses supplied in WIND. Comparisons have been made with static pressure measurements, with boundary-layer rake and flowfield rake pitot pressure measurements, and with temperature sensitive paint experimental results. Using WIND's parabolized Navier-Stokes capability, grid sequencing, and the Baldwin-Lomax algebraic turbulence model allowed for significant reductions in computational time while still providing good agreement with experiment. Given that CFD and experiment compare well, WIND is found to be a good computational platform for solving this type of forebody problem, and the grids developed in conjunction with it will be used in the future to investigate varying freestream conditions not tested experimentally.

Frate, F. C.↗

NASA NTRS1992

An iterative implicit DDADI algorithm for solving the Navier-Stokes equation

An algorithm utilizing a first order upwind split flux technique and the diagonally dominant treatment is proposed to be the temporal operator for solving the Navier-Stokes equations. Given the limit of a five point stencil, the right hand side flux derivatives are formulated by several commonly used central and upwind schemes. Their performances are studied through a test case of free vortex convection in a uniform stream. From these results, a superior treatment for evaluating the flux term is proposed and compared with the rest. The application of the proposed algorithm to the full Navier-Stokes equations is demonstrated through a calculation of flow over a backward facing step. Results are compared against the calculation done by using the fourth order central differencing scheme with artificial damping.

Chen, S. C.↗