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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 955 records · Page 53
All sourcesNASA NTRSDOE OSTI
DOE OSTI2017

Scientific Computation Application Partnerships in Materials and Chemical Sciences, Charge Transfer and Charge Transport in Photoactivated Systems, Developing Electron-Correlated Methods for Excited State Structure and Dynamics in the NWChem Software Suite

Charge transfer and charge transport in photoactivated systems are fundamental processes that underlie solar energy capture, solar energy conversion, and photoactivated catalysis, both organometallic and enzymatic. We developed methods, algorithms, and software tools needed for reliable treatment of the underlying physics for charge transfer and charge transport, an undertaking with broad applicability to the goals of the fundamental-interaction component of the Department of Energy Office of Basic Energy Sciences and the exascale initiative of the Office of Advanced Scientific Computing Research.

14 SOLAR ENERGY↗
DOE OSTI2017

Dakota Technical Support Demonstrations and Software Improvements

Caterpillar, Inc. (Caterpillar) and Sandia National Laboratories (SNL) continued their partnership to improve SNL's open source Dakota software product and effectively deploy it to Caterpillar engineering design and analysis problems. Several new features that are expected to benefit not only Caterpillar but also the entire Dakota user community were introduced. In addition, SNL and Caterpillar cooperated extensively to conduct a demonstration of Dakota's uncertainty quantification capabilities on a computational simulation of relevance to Caterpillar.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2017

BLACKCOMB2: Hardware-software co-design for non-volatile memory in exascale systems

This work was part of a larger project, Blackcomb2, centered at Oak Ridge National Labs (Jeff Vetter PI) to investigate the opportunities for replacing or supplementing DRAM main memory with nonvolatile memory (NVmemory) in Exascale memory systems. The goal was to reduce the energy consumed by in future supercomputer memory systems and to improve their resiliency. Building on the accomplishments of the original Blackcomb Project, funded in 2010, the goal for Blackcomb2 was to identify, evaluate, and optimize the most promising emerging memory technologies, architecture hardware and software technologies, which are essential to provide the necessary memory capacity, performance, resilience, and energy efficiency in Exascale systems. Capacity and energy are the key drivers.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2018

Solar Ready Vets: Software Deliverables Report

The website and members-only portal for Solar Ready Vets exists as a part of the Solar Training Network. Initially it was our intent to duplicate the Solar Training Network site to create a website and member-only portal for Solar Ready Vets. However, a no-go decision from DOE was rendered in the process of website development for The Solar Training Network. As a result, the site was never duplicated for Solar Ready Vets. Thus, the only dedicated website that existed for Solar Ready Vets was housed on The Solar Foundation’s website, and was created in house (solarreadyveterans.org), not with Federally awarded funds. Therefore, Solar Ready Vets hereby submits this negative report that no software was developed as a project deliverable for DOE award #DE-EE0007320.

14 SOLAR ENERGY↗
DOE OSTI2017

XPRESS: eXascale PRogramming Environment and System Software

The XPRESS Project is one of four major projects of the DOE Office of Science Advanced Scientific Computing Research X-stack Program initiated in September, 2012. The purpose of XPRESS is to devise an innovative system software stack to enable practical and useful exascale computing around the end of the decade with near-term contributions to efficient and scalable operation of trans-Petaflops performance systems in the next two to three years; both for DOE mission-critical applications. To this end, XPRESS directly addresses critical challenges in computing of efficiency, scalability, and programmability through introspective methods of dynamic adaptive resource management and task scheduling.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2018

Implementation of Software QA for SAS4A/SASSYS-1 Rev. 1

In an effort to support closure of gaps in advanced reactor licensing pathways, a multi-year task to systematically develop sodium-cooled fast reactor (SFR) codes and methods for use in a licensing framework was launched as part of the DOE-NE Advanced Reactor Technologies (ART) Program’s Regulatory Technology Development Plan (RTDP). This report documents Phase 2 of this task, which was focused on the finalization and initial implementation of a software quality assurance (SQA) program for SAS4A/SASSYS-1 and completion of high-priority SQA-related technical activities. The ultimate goal of this ongoing RTDP task is to develop an SQA framework that satisfies the fundamental requirements of relevant SQA standards and guidance while still maintaining sufficient flexibility and efficiency such that the framework can be sustained with modest resources.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
DOE OSTI2018

HEP Software Foundation Community White Paper Working Group - Data Analysis and Interpretation

At the heart of experimental high energy physics (HEP) is the development of facilities and instrumentation that provide sensitivity to new phenomena. Our understanding of nature at its most fundamental level is advanced through the analysis and interpretation of data from sophisticated detectors in HEP experiments. The goal of data analysis systems is to realize the maximum possible scientific potential of the data within the constraints of computing and human resources in the least time. To achieve this goal, future analysis systems should empower physicists to access the data with a high level of interactivity, reproducibility and throughput capability. As part of the HEP Software Foundation Community White Paper process, a working group on Data Analysis and Interpretation was formed to assess the challenges and opportunities in HEP data analysis and develop a roadmap for activities in this area over the next decade. In this report, the key findings and recommendations of the Data Analysis and Interpretation Working Group are presented.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2018

Request for Information FEARCE: An extensible finite element multiphysics software suite for complex and reactive modeling

FEARCE is a modular multiphysics software package configured as a suite of fully-integrated tools that leverages custom templates and models alongside finite element analysis and computational fluid dynamics. FEARCE produces fast, high-fidelity solutions for any aspiring designer needing to model and predict turbulent, reactive, and otherwise complex fluid flows.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2018

Open Source Software for HPC

The computational power of HPC is beyond our comprehension when we hear that 5 quadrillion computations can happen in a matter of seconds, or that machine learning is changing the way everything works. But none of that happens in a vacuum, and the teams behind the scenes—the developers of the hardware, the operating systems, the data transfer protocols, and the applications themselves—are the unsung heroes of a world where faster is better and you'd better hope there's no bug in the software or the hardware to slow you down. HPC is most successful when all these aspects work together seamlessly. The stories that follow are a tribute to the hardworking teams behind the scenes.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2017

RELAP-7 Software Verification and Validation Plan: Requirements Traceability Matrix (RTM) Update and Code Verification Strategy

This document describes the recent progress of the RELAP-7 Software Verification and Validation Plan (SVVP). The RELAP-7 RTM has been updated by adding the validation requirement items, rearranging the requirement items, and introducing the classifier to better describe the RELAP-7 V&V status at a specified point in time. Also, from the perspective of nuclear system code validation, six items from the list of LWR safety-relevant phenomena were identified as validation data gaps. Lastly, motivated by the needs revealed from the previous RELAP-7 IV&V activities, the independent verification plan for RELAP-7 has been established. The verification method, procedure, and verification test coverage suite discussed in this document will be applied to the future work for the RELAP-7 independent verification.

42 ENGINEERING↗
DOE OSTI2018

Vanguard Astra and ATSE – an ARM-based Advanced Architecture Prototype System and Software Environment (FY18 L2 Milestone #8759 Report)

The Vanguard program informally began in January 2017 with the submission of a white paper entitled "Sandia's Vision for a 2019 Arm Testbed" to NNSA headquarters. The program proceeded in earnest in May 2017 with an announcement by Doug Wade (Director, Office of Advanced Simulation and Computing and Institutional R&D at NNSA) that Sandia National Laboratories (Sandia) would host the first Advanced Architecture Prototype platform based on the Arm architecture. In August 2017, Sandia formed a Tri-lab team chartered to develop a robust HPC software stack for Astra to support the Vanguard program goal of demonstrating the viability of Arm in supporting ASC production computing workloads.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2018

Umpire: Integration with Other Software Technologies

Umpire is an open-source C++ library that provides memory and resource management functions for use with heterogeneous memory spaces. The Umpire library is being developed to simplify coordination and sharing of limited memory resources for complex integrated applications developed in the ECP/ATDM and ASC programs, and other multi-physics codes that combine many physics packages and libraries. The overarching goal of Umpire is to provide a single application-facing API for memory management on all platforms by decoupling memory operations from platform-specific memory spaces. It provides operations for: memory space discovery, memory provisioning, allocation and transfers, and introspection. Umpire development began in the Center for Applied Scientific Computing at Lawrence Livermore National Laboratory (LLNL). Umpire is funded primarily by LLNL ASC and ATMD portfolios and receives a small amount of support as part of ECP ST Project 2.3.1.06 STMP08-ISC. The source code is hosted and developed on GitHub. In this report, we explore possible integrations with other memory hierarchy management software. We examine both projects supported by ECP, as well as third-party and vendor provided tools.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2019

Software Development: A Tool for Smart Integration of Solar Power (Final Report)

As part of its SunShot funded Grid Assessor work Kevala assembled a team with deep electricity market, solar, software and product expertise to address a significant problem - reducing the risk of investing in solar by determining the inherent value of solar electricity based on the location where it is produced. Kevala’s Grid Assessor product is now in the market transforming the way solar assets are proposed, assessed, and financed, resulting in lower capital costs, the opening of new markets, and the streamlining of siting in the utility scale portion of the solar industry. Grid assessor accomplishes this by using detailed electricity infrastructure data, pricing information, GIS mapping, and proprietary algorithms to lower financial risk by providing transparency into the current and future value of projects based on their location.

14 SOLAR ENERGY↗
DOE OSTI2018

Directional Software Algorithms and Sensor Evaluations

This report evaluates the relative performance of two directional gamma-ray spectrometers and processing algorithms that are used to construct images and spatially resolved spectra. Polaris, which was developed by H3D Inc., uses 18 pixelated CZT crystals to construct gamma-ray images in either Compton camera(CC) or coded aperture (CA) mode. The other sensor that is referenced in this report incorporates a commercial high-purity germanium based imager, called GeGI, with a coded aperture mask and processing software developed by Oak Ridge National Laboratory (ORNL). H3D and the University of Michigan provided several algorithms that can be used to process data collected by Polaris in CC mode. This evaluation compares the performance of these algorithms with a Directional Unfolded Source Term (DUST) approach developed by Sandia National Laboratories (SNL). DUST differs from the other algorithms because its primary objective is synthesis of spatially-resolved gamma ray spectra as opposed to image reconstruction.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2019

Report for 2.2.1 Task 4: Software-Based Tools to Support Human-System Evaluation Studies

INL contracted IFE to develop custom software functionality to support INL’s control room simulator data collections. The tool described in this report provides functionality for authoring, managing and executing so-called micro task data collections (Hildebrandt and Eitrheim, 2015), where operators receive a long list of operational tasks, and the speed and accuracy of their response is measured. The tool consists of an editor, player and observer module. This report contains methodological background and a user guide.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
DOE OSTI2019

Software Requirement Document: Benchmarking Algorithms for RadioNuclide Identification (BARNI)

The Department of Energy (DOE) Office of Nuclear Smuggling Detection and Deterrence (NSDD) seeks to improve the performance of RadioIsotope Identification Devices (RIIDs). RIIDs enable users to identifying threat nuclides in applications such as secondary search, facility inspection, and emergency response. As part of this effort NSDD has developed Replicative Assessment of Spectroscopic Equipment (RASE), an open-source tool which generates synthetic spectra and analyzes them with vendor’s radionuclide identification software in order to evaluate performance.

61 RADIATION PROTECTION AND DOSIMETRY↗