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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 91 records · Page 5
All sourcesNASA NTRSDOE OSTI
DOE OSTI2017

Long-time molecular dynamics simulations on massively parallel platforms: A comparison of parallel replica dynamics and parallel trajectory splicing

Molecular dynamics (MD) is one of the most widely used techniques in computational materials science. By providing fully resolved trajectories, it allows for a natural description of static, thermodynamic, and kinetic properties. A major hurdle that has hampered the use of MD is the fact that the timescales that can be directly simulated are very limited, even when using massively parallel computers. We compare two time-parallelization approaches, parallel replica dynamics (ParRep) and parallel trajectory splicing (ParSplice), that were specifically designed to address this issue for rare event systems by leveraging parallel computing resources. Using simulations of the relaxation of small disordered platinum nanoparticles, a comparative performance analysis of the two methods is presented. Finally, the results show that ParSplice can significantly outperform ParRep in the common case where the trajectory remains trapped for a long time within a region of configuration space but makes rapid structural transitions within this region.

36 MATERIALS SCIENCE↗
DOE OSTI2023

On display: Replica instruments used to discover electrons, neutrons and more

Believe it or not, the electron was discovered in 1897 using only a hand-blown glass tube, a vacuum pump and some electrodes. Historical instrument replicas now on display in the lobby of the J.R. Oppenheimer Center give visitors a chance to remember the elegance — and relative simplicity — of the instruments scientists built and used to make pivotal discoveries.

47 OTHER INSTRUMENTATION↗
DOE OSTI2023

A Tutorial for Generating Correlated Random Samples in the Context of Replica Cross Section Data Used in the Propagation of Uncertainty (Second Edition)

The following sample problem write-ups are designed as a tutorial for generating correlated random samples (e.g., replica multi-group cross section data) for use in propagation of uncertainty problems. These problems were set up and solved in MATLAB, but any programming environment with basic statistical functions can be used to generate similar results. Since linear sample problems were chosen, helpful comparisons to the “sandwich” rule propagation of uncertainty are available and were used.

97 MATHEMATICS AND COMPUTING↗
NASA NTRS1986

Measurement and prediction of flow through a replica segment of a mildly atherosclerotic coronary artery of man

Pressure distributions were measured along a hollow vascular axisymmetric replica of a segment of the left circumflex coronary artery of man with mildly atherosclerotic diffuse disease. A large range of physiological Reynolds numbers from about 60 to 500, including hyperemic response, was spanned in the flows investigation using a fluid simulating blood kinematic viscosity. Predicted pressure distributions from the numerical solution of the Navier-Stokes equations were similar in trend and magnitude to the measurements. Large variations in the predicted velocity profiles occurred along the lumen. The influence of the smaller scale multiple flow obstacles along the wall (lesion variations) led to sharp spikes in the predicted wall shear stresses. Reynolds number similarity was discussed, and estimates of what time averaged in vivo pressure drop and shear stress might be were given for a vessel segment.

Back, L. H.↗
NASA NTRS2003

The 2003 Goddard Rocket Replica Project

A group of volunteers from Marshall Space Flight Center using information and records available,construct a working, flying replica of Robert Goddard's 1926 liquid rocket as well as accurate static display version. Document the effort for posterity.

Farr, Rebecca A.↗
NASA NTRS2003

The 2003 Goddard Rocket Replica Project: A Reconstruction of the World's First Functional Liquid Rocket System

As a part of NASA s 2003 Centennial of Flight celebration, engineers and technicians at Marshall Space Flight Center (MSFC), Huntsville, Alabama, in cooperation with the Alabama-Mississippi AIAA Section, have reconstructed historically accurate, functional replicas of Dr. Robert H. Goddard s 1926 first liquid- fuel rocket. The purposes of this project were to clearly understand, recreate, and document the mechanisms and workings of the 1926 rocket for exhibit and educational use, creating a vital resource for researchers studying the evolution of liquid rocketry for years to come. The MSFC team s reverse engineering activity has created detailed engineering-quality drawings and specifications describing the original rocket and how it was built, tested, and operated. Static hot-fire tests, as well as flight demonstrations, have further defined and quantified the actual performance and engineering actual performance and engineering challenges of this major segment in early aerospace history.

R. A. Farr↗
NASA NTRS2008

Replica-Based Crack Inspection

Surface replication has been proposed as a method for crack detection in space shuttle main engine flowliner slots. The results of a feasibility study show that examination of surface replicas with a scanning electron microscope can result in the detection of cracks as small as 0.005 inch, and surface flaws as small as 0.001 inch, for the flowliner material.

Newman, John A.↗
NASA NTRS2024

Contributions of irrigation modeling, soil moisture and snow data assimilation to high-resolution water budget estimates over the Po basin: progress towards digital replicas

High-resolution water budget estimates benefit from modeling of human water management and satellite data assimilation (DA) in river basins with a large human footprint. Utilizing the Noah-MP land surface model with dynamic vegetation growth and river routing, in combination with an irrigation module, Sentinel-1 backscatter and snow depth retrievals, we produce a set of 0.7-km2 water budget estimates of the Po river basin (Italy) for 2015–2023. The results demonstrate that irrigation modeling improves the seasonal soil moisture variation and summer streamflow at all gauges in the valley after withdrawal of irrigation water from the streamflow in postprocessing (12% error reduction relative to observed low summer streamflow), even if the basin-wide irrigation amount is underestimated. Sentinel-1 backscatter DA for soil moisture updating strongly interacts with irrigation modeling: when both are activated, the soil moisture updates are limited, and the simulated irrigation amounts are reduced. Backscatter DA systematically reduces soil moisture in the spring, which improves downstream spring streamflow. Assimilating Sentinel-1 snow depth retrievals over the surrounding Alps and Apennines further improves spring streamflow in a complementary way (2% error reduction relative to observed high spring streamflow). Despite the seasonal improvements, irrigation modeling and Sentinel-1 backscatter DA cannot significantly improve short-term or interannual variations in soil moisture, irrigation modeling causes a systematically prolonged high vegetation productivity, and snow depth DA only impacts the deep snowpacks. This study helps advancing the design of digital water budget replicas for river basins.

Gabrielle J M De Lannoy↗
DOE OSTI2014

Performance of Replica-Exchange Wang-Landau Sampling for the 2D Ising Model: A Brief Survey

We report a brief performance study of the replica-exchange Wang-Landau algorithm, a recently proposed parallel realization of Wang-Landau sampling, using the 2D Ising model as a test case. The simulation time is found to scale inversely with the square root of the number of subwindows (and thus number of processors) used to span the global parameter space. We also investigate the time profiles for random walkers in dierent subwindows to complete iterations, which will aid the development of and adaptive load-balancing scheme.

Zhao, Yiwei↗
DOE OSTI2015

Replica-exchange Wang Landau sampling: pushing the limits of Monte Carlo simulations in materials sciences

We describe the study of thermodynamics of materials using replica-exchange Wang Landau (REWL) sampling, a generic framework for massively parallel implementations of the Wang Landau Monte Carlo method. To evaluate the performance and scalability of the method, we investigate the magnetic phase transition in body-centered cubic (bcc) iron using the classical Heisenberg model parameterized with first principles calculations. We demonstrate that our framework leads to a significant speedup without compromising the accuracy and precision and facilitates the study of much larger systems than is possible with its serial counterpart.

Perera, Meewanage Dilina N↗
DOE OSTI2023

Visual, Optical and Replica Inspections: Surface Preparation of 650 MHz NB Cavity for PIP-II Linac

Surface preparation of niobium superconducting RF cavities is a critical step for achieving good RF performance under the superconducting state. Surface defect, roughness, and contamination affect the accelerating gradient and quality factor of the cavities. We report surface inspection methods used to control the surface processing of 650 MHz cavities designated for the pre-production and prototype cryomodules for PIP-II linac. The cavity surface was routinely inspected visually, with an optical camera, and by microscopic scanning of surface replicas. This article covers details on the surface inspection methods and surface polishing process used to repair the surface.

43 PARTICLE ACCELERATORS↗