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At least 487 records · Page 27

Description of the Process Model for the Technoeconomic Evaluation of MEA versus Mixed Amines for Carbon Dioxide Removal from Stack Gas

This model description is supplemental to the Lawrence Livermore National Laboratory (LLNL) report LLNL-TR-642494, Technoeconomic Evaluation of MEA versus Mixed Amines for CO2 Removal at Near- Commercial Scale at Duke Energy Gibson 3 Plant. We describe the assumptions and methodology used in the Laboratory’s simulation of its understanding of Huaneng’s novel amine solvent for CO2 capture with 35% mixed amine. The results of that simulation have been described in LLNL-TR-642494. The simulation was performed using ASPEN 7.0. The composition of the Huaneng’s novel amine solvent was estimated based on information gleaned from Huaneng patents. The chemistry of the process was described using nine equations, representing reactions within the absorber and stripper columns using the ELECTNRTL property method. As a rate-based ASPEN simulation model was not available to Lawrence Livermore at the time of writing, the height of a theoretical plate was estimated using open literature for similar processes. Composition of the flue gas was estimated based on information supplied by Duke Energy for Unit 3 of the Gibson plant. The simulation was scaled at one million short tons of CO2 absorbed per year. To aid stability of the model, convergence of the main solvent recycle loop was implemented manually, as described in the Blocks section below. Automatic convergence of this loop led to instability during the model iterations. Manual convergence of the loop enabled accurate representation and maintenance of model stability.

01 COAL, LIGNITE, AND PEAT↗

Similarity Analysis: Comparison of a Standard 60mL With a 50mL Container for MicroCT

A 50mL container with a one inch outer diameter has been proposed for holding specimen materials scanned at LLNL and Tyndall Air Force Research Laboratory (TAFRL). In order to determine whether or not this new container would significantly affect MicroCT results, a similarity analysis procedure developed at LLNL was used. This procedure compares multiple first and second order statistics obtained from CT reconstructed images generated by the MicroCT analysis process, and prescribes similarity constraints as guidance. For this study, water was scanned on the MicroCT system at LLNL, twice in the standard 60mL container and twice in the proposed 50mL container. Data were analyzed following the Standard Operating Procedure (SOP) for MicroCT analysis. Comparison of analytical results shows that the new container does not satisfy all similarity analysis criteria (certain second order statistics are outside of similarity analysis constraints).

42 ENGINEERING↗

ICP-MS Workshop

This is a short document that explains the materials that will be transmitted to LLNL and DNN HQ regarding the ICP-MS Workshop held at PNNL June 17-19th. The goal of the information is to pass on to LLNL information regarding the planning and preparations for the Workshop at PNNL in preparation of the SIMS workshop at LLNL.

98 NUCLEAR DISARMAMENT, SAFEGUARDS, AND PHYSICAL P↗

2011 Release of the Evaluated Nuclear Data Library (ENDL2011.0)

LLNL’s Computational Nuclear Physics Group and Nuclear Theory and Modeling Group have collaborated to produce the last of three major releases of LLNL’s evaluated nuclear database, ENDL2011. ENDL2011 is designed to support LLNL’s current and future nuclear data needs by providing the best nuclear data available to our programmatic customers. This library contains many new evaluations for radiochemical diagnostics, structural materials, and thermonuclear reactions. We have made an effort to eliminate all holes in reaction networks, allowing in-line isotopic creation and depletion calculations. We have striven to keep ENDL2011 at the leading edge of nuclear data library development by reviewing and incorporating new evaluations as they are made available to the nuclear data community. Finally, this release is our most highly tested release as we have strengthened our already rigorous testing regime by adding tests against IPPE Activation Ratio Measurements, many more new critical assemblies and a more complete set of classified testing (to be detailed separately).

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Characterization of Proxy Application Performance on Advanced Architectures. UMT2013, MCB, AMG2013

Three codes were tested at LLNL as part of a Tri-Lab effort to make detailed assessments of several proxy applications on various advanced architectures, with the eventual goal of extending these assessments to codes of programmatic interest running more realistic simulations. Teams from Sandia and Los Alamos tested proxy apps of their own. The focus in this report is on the LLNL codes UMT2013, MCB, and AMG2013. We present weak and strong MPI scaling results and studies of OpenMP efficiency on a large BG/Q system at LLNL, with comparison against similar tests on an Intel Sandy Bridge TLCC2 system. The hardware counters on BG/Q provide detailed information on many aspects of on-node performance, while information from the mpiP tool gives insight into the reasons for the differing scaling behavior on these two different architectures. Results from three more speculative tests are also included: one that exploits NVRAM as extended memory, one that studies performance under a power bound, and one that illustrates the effects of changing the torus network mapping on BG/Q.

97 MATHEMATICS AND COMPUTING↗

CERT TST December 2015 Visit Summary

The annual PSAAP II TST visit to Texas A&M’s CERT Center was held on December 1-3, 2015. The agenda for the visit is attached. Non-TAMU attendees were: TST Members – Teresa Bailey (LLNL), Todd Gamblin (LLNL), Bob Little (LANL) – Chair, Chad Olinger (LANL), Shawn Pautz (SNL), Alan Williams (SNL);Other Lab staff – Skip Kahler (LANL), Ana Kupresanin (LLNL), and Rob Lowrie (LANL); AST Members – Nelson Hoffman (LANL) and Bob Voigt (Leidos) The TST wishes to express our appreciation to all involved with CERT for the high-quality posters and presentations and for the attention to logistics that enabled a successful visit. We have broken our comments into four sections: (1) Kudos, (2) Recommendations, (3) Feedback on Priorities for April Review, and (4) Follow-Up Activities with Labs.

99 GENERAL AND MISCELLANEOUS↗

Technical Safety Requirements for the Waste Storage Facilities May 2014

This document contains the Technical Safety Requirements (TSR) for the Radioactive and Hazardous Waste Management (RHWM) WASTE STORAGE FACILITIES, which include Area 625 (A625) and the Building 693 (B693) Yard Area of the Decontamination and Waste Treatment Facility (DWTF) at LLNL. The TSRs constitute requirements for safe operation of the WASTE STORAGE FACILITIES. These TSRs are derived from the Documented Safety Analyses for the Waste Storage Facilities (DSA) (LLNL 2011). The analysis presented therein concluded that the WASTE STORAGE FACILITIES are low-chemical hazard, Hazard Category 2 non-reactor nuclear facilities. The TSRs consist primarily of inventory limits and controls to preserve the underlying assumptions in the hazard and accident analyses. Further, appropriate commitments to safety programs are presented in the administrative controls sections of the TSRs. The WASTE STORAGE FACILITIES are used by RHWM to handle and store hazardous waste, TRANSURANIC (TRU) WASTE, LOW-LEVEL WASTE (LLW), mixed waste, California combined waste, nonhazardous industrial waste, and conditionally accepted waste generated at LLNL as well as small amounts of waste from other DOE facilities, as described in the DSA. In addition, several minor treatments (e.g., size reduction and decontamination) are carried out in these facilities.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Regional Coda 2-D P and S-wave Calibration, Support, and Coda Tool Development

The following describes work completed between April 2014 through February 2016. As in past years, Dr. Mayeda is a point of contact for LLNL’s colleagues in Florida and provides calibration, troubleshooting support, integration of new coda-related products, and processing for events and regions of interest. He has been responsible for integrating new coda-related products from ongoing BAA projects with his LLNL counterparts. Over the past two years Dr. Mayeda visited with Florida scientists to spot check and validate 1-D coda calibrations for the YSKP, BARM, and Zagros regions. In addition, a new region of interest was identified and will be the subject of ongoing research into the next fiscal year. Dr. Mayeda is consulting with LLNL scientists on how best to transition and test 2-D coda calibrations for the broader Middle East region using GT source spectra as constraints. This region is laterally very complicated and initial coda studies show that variance reduction could be significant if 2-D path and envelope shape are incorporated.

58 GEOSCIENCES↗

Emergency Response Capability Baseline Needs Assessment - Compliance Assessment

This document was prepared by John A. Sharry, LLNL Fire Marshal and Division Leader for Fire Protection and was reviewed by LLNL Emergency Management Department Head, James Colson. This document is the second of a two-part analysis on Emergency Response Capabilities of Lawrence Livermore National Laboratory. The first part, 2016 Baseline Needs Assessment Requirements Document established the minimum performance criteria necessary to meet mandatory requirements. This second part analyses the performance of Lawrence Livermore Laboratory Emergency Management Department to the contents of the Requirements Document. The document was prepared based on an extensive review of information contained in the 2016 BNA, a review of Emergency Planning Hazards Assessments, a review of building construction, occupancy, fire protection features, dispatch records, LLNL alarm system records, fire department training records, and fire department policies and procedures. The 2013 BNA was approved by NNSA’s Livermore Field Office on January 22, 2014.

99 GENERAL AND MISCELLANEOUS↗

Emergency Response Capability Baseline Needs Assessment - Requirements Document

This document was prepared by John A. Sharry, LLNL Fire Marshal and LLNL Division Leader for Fire Protection and reviewed by LLNL Emergency Management Department Head James Colson. The document follows and expands upon the format and contents of the DOE Model Fire Protection Baseline Capabilities Assessment document contained on the DOE Fire Protection Web Site, but only addresses emergency response.

99 GENERAL AND MISCELLANEOUS↗

Porting AMG2013 to Heterogeneous CPU+GPU Nodes

LLNL's future advanced technology system SIERRA will feature heterogeneous compute nodes that consist of IBM PowerV9 CPUs and NVIDIA Volta GPUs. Conceptually, the motivation for such an architecture is quite straightforward: While GPUs are optimized for throughput on massively parallel workloads, CPUs strive to minimize latency for rather sequential operations. Yet, making optimal use of heterogeneous architectures raises new challenges for the development of scalable parallel software, e.g., with respect to work distribution. Porting LLNL's parallel numerical libraries to upcoming heterogeneous CPU+GPU architectures is therefore a critical factor for ensuring LLNL's future success in ful lling its national mission. One of these libraries, called HYPRE, provides parallel solvers and precondi- tioners for large, sparse linear systems of equations. In the context of this intern- ship project, I consider AMG2013 which is a proxy application for major parts of HYPRE that implements a benchmark for setting up and solving di erent systems of linear equations. In the following, I describe in detail how I ported multiple parts of AMG2013 to the GPU (Section 2) and present results for di erent experiments that demonstrate a successful parallel implementation on the heterogeneous ma- chines surface and ray (Section 3). In Section 4, I give guidelines on how my code should be used. Finally, I conclude and give an outlook for future work (Section 5).

97 MATHEMATICS AND COMPUTING↗

An Advanced Geomechanics Simulation Framework to Connect Induced Microseismic Events to their Sources. CRADA TC02193 Final Report

This was a collaborative effort between Lawrence Livermore National Security, LLC as manager and operator of Lawrence Livermore National Laboratory (LLNL) and ION Geophysical. The main goal of the proposed effort was to develop industry-leading state of the art modeling and analysis capabilities to address an important aspect of hydraulic fracturing operations -- the evolution of the fracture network in the subsurface and the associated generation of the microseismic signals associated with the creation of the fracture network. The proposed effort leveraged on-going code development activities at LLNL. The codes used to execute the proposed research were to be transitioned to ION Geophysical through a visitor exchange program whereby ION Geophysical employees would visit LLNL and interact with the code developers and subject matter experts enabling them to develop the technical understanding and the expertise needed to independently perform simulations and analyze results.

42 ENGINEERING↗

Level-2 Milestone 6007: Sierra Early Delivery System Deployed to Secret Restricted Network

This report documents the delivery and installation of Shark, a CORAL Sierra early delivery system deployed on the LLNL SRD network. Early ASC program users have run codes on the machine in support of application porting for the final Sierra system which will be deployed at LLNL in CY2018. In addition to the SRD resource, Shark, unclassified resources, Rzmanta and Ray, have been deployed on the LLNL Restricted Zone and Collaboration Zone networks in support of application readiness for the Sierra platform.

97 MATHEMATICS AND COMPUTING↗

Laser Materials Processing Final Report CRADA No. TC-1526-98

This CRADA project was a joint effort between Lawrence Livermore National Laboratory (LLNL) and United Technologies Corporation (UTC)/Pratt & Whitney (P&W) to demonstrate process capability for drilling holes in turbine airfoils using LLNL-developed femtosecond laser machining technology. The basis for this development was the ability of femtosecond lasers to drill precision holes in variety of materials with little or no collateral damage. The ultimate objective was to develop a laser machine tool consisting of an extremely advanced femtosecond laser subsystem to be developed by LLNL on a best-effort basis and a drilling station for turbine blades and vanes to be developed by P&W. In addition, P&W was responsible for commercializing the system. The goal of the so called Advanced Laser Drilling (ALD) system was to drill specified complex hole-shapes in turbine blades and vanes with a high degree precision and repeatability and simultaneously capable of very high speed processing.

36 MATERIALS SCIENCE↗

Lawrence Livermore National Laboratory and Sandia National Laboratory Nuclear Accident Dosimetry Support of IER 252 and the Dose Characterization of the Flattop Reactor at the DAF

In support of IER 252 “Characterization of the Flattop Reactor at the NCERC”, LLNL performed ROSPEC measurements of the neutron spectrum and deployed 129 Personnel Nuclear Accident Dosimeters (PNAD) to establish the need for height corrections and verification of neutron spectrum evaluation of the fluences and dose. A very limited number of heights (typically only one or two heights) can be measured using neutron spectrometers, therefore it was important to determine if any height correction would be needed in future intercomparisons and studies. Specific measurement positions around the Flatttop reactor are provided in Figure 1. Table 1 provides run and position information for LLNL measurements. The LLNL ROSPEC (R2) was used for run numbers 1 – 7, and vi. PNADs were positioned on trees during run numbers 9, 11, and 13.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Optical Mode Converters Final Report CRADA No. TC-0838-94

The information age was maturing, and photonics was emerging as a significant technology with important'national security and commercial implications at the time of the CRADA. This was largely due to the vast information carrying capacity of optical beams and the availability of cheap.and effective optical fiber waveguides to guide the light. However, a major limitation to the widespread deployment of photonic systems was the high-cost (in an economic and performance sense) associated with coupling optical power between optoelectronic waveguide devices or between a device and an optical fiber. The problem was critical in the case of single-mode waveguide devices. Mitigating these costs would be a significant and pervasive enabler of the technology for a wide variety of applications that would have crucial defense and economic impact. The partners worked together to develop optical mode size converters on silicon substrates. Silicon was chosen because of its compatibility with the required photolithographic and micromachining techniques. By choosing silicon, these techniques could enable the close coupling of high-speed, high density silicon electronic circuitry to efficient low-cost photonics. The efficient coupling of electronics and photonics technologies would be important for many information age technologies. The joint nature of this project was intended to allow HP to benefit from some unique LLNL capabilities, and LLNL would be in a position to learn from HP and enhance its value to fundamental DP missions. Although the CRADA began as a hardware development project to develop the mode converter, it evolved into a software development venture. LLNL and HP researchers examined literature, performed some preliminary calculations, and evaluated production trade-offs of several known techniques to determine the best candidates for an integrated system.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Collaborative, Nondestructive Analysis of Contaminated Soil

This report summarizes a joint nondestructive analysis exercise that LLNL, LANL, and COMENA discussed through a collaborative meeting in July 2017. This work was performed as one part of a collaboration with Algeria under Action Sheet 7: “Technical Cooperation and Assistance in Nuclear Forensics”. The primary intent of this exercise was for US and Algerian participants to jointly share results of nondestructive analyses (NDA) of a contaminated soil sample provided by the Algerians and to discuss key observations and analytical approaches. While the two samples were analyzed blind at LLNL and LANL, the soil samples were revealed after the exercise to have a common origin, and to have originated as an IAEA soil sample (IAEA-326, Bojanowski et al., 2001) provided to COMENA as part of a previous exercise. Comparative analysis revealed common findings between the laboratories, and also emphasized the need for standardized operating procedures to improve inter-comparability and confidence in conclusions. Recommended handling practices in the presence of sample heterogeneities were also discussed. This exercise provided an opportunity to demonstrate nuclear forensics analytical capabilities at COMENA, LANL, and LLNL, and identified areas that could benefit from future technical exchanges. Plans were made for a follow-on joint exercise in 2018, involving destructive analyses of the CUP-2 uranium ore concentrate standard.

38 RADIATION CHEMISTRY, RADIOCHEMISTRY, AND NUCLEA↗

High Temperature Catalytic Combustion Suppports Final Report CRADA No. TSB-0841-94

This Small Business CRADA between LLNL and Catalytica was executed on January 25, 1995. The total estimated cost of this project was 113K. LLNL's contribution was estimated at $50K funded under the DOE/Defense Program Small Business Initiative. Catalytica's in-kind contribution was estimated at 63K. Catalytic combusion catalyst systems operate at temperatures from 600°C to above 1300°C. Catalytica has developed technology that limits the catalyst temperature to below 1000°C. At temperatures in the range of 850 to 1000°C, the thermal stability of the catalyst is an important issue. Typical supports such as stabilized aluminas, hexaluminates, zirconia and stabilized zirconia supports are typically used but lack either thermal stability or other desirable properties. Catalytica had developed a new concept for thermally stable mixed oxide supports but this concept required the preparation of molecularly uniform precursors; that is, prior to high temperature treatment of these materials, the elements that make up the mixed oxide must be as nearly uniform as possible on a molecular level. The technique of sol gel processing appeared to be the preferred technique to make these molecularly uniform precursors, and a cooperative program with LLNL was established to prepare and test the proposed compounds. Catalytica proposed the composition and concentration levels for the materials to be prepared.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗