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At least 469 records · Page 26

Design, Development and Testing Plan for Energy Efficiency Algorithms Related to Building-Integrated Cooling, Heating, and Power Systems

Building-integrated cooling, heating and power (CHP) systems are more efficient than conventional systems at providing local power and thermal energy, and favorable fuel prices are bound to spur their increased adoption. It is estimated that the total CHP technical potential in the commercial building sector is approximately 76 GW, but only a small fraction of it is actually deployed. Advanced control and monitoring systems that realize the full potential of these CHP systems can transform this capacity into an asset for both the owner and the grid and also accelerate the adoption of these systems in the building sector. However, to realize the full benefit of the CHP systems, we must ensure persistence of energy efficient operations. It has been demonstrated by several studies that as much as 30% of building energy use is wasted. Much of the waste results from the inability to anticipate load variations (design day vs. non-design day operations; diurnal variation of loads), identify improper operation, and efficiently operate, control and maintain building systems. Moreover, many buildings, even those with adequate control infrastructure, lack knowledgeable staff to operate and maintain energy systems. Operators of buildings with CHP systems will constantly need to make tradeoffs (economic dispatch) between onsite power generation and purchasing power, between onsite heat production from distributed generation versus heating/cooling from conventional systems, and different passive and active load management measures. Much of the inefficiency in the current building operations can be eliminated by use of automated performance monitoring (PM), real-time commissioning verification (CxV) and automated fault detection and diagnostic (AFDD) tools. Automation can help system operators make intelligent decisions. Remote and continuous monitoring of system conditions and performance will enable better management and integration of CHP with existing building systems. Continuous PM, real-time CxV and AFDD could alleviate burdens for operations staff, enhance operations and maintenance (O&M), and improve reliability of building and CHP systems. To address the O&M challenges and to provide a means to maximize the rate-of-return of building-integrated CHP systems, the Building Technologies Office (BTO) within the U.S. Department of Energy’s (DOE’s) Office of Energy Efficiency and Renewable Energy (EERE) initiated a project to design, develop, and field test a VOLTTRON™-based supervisory controller and associated open-source algorithms. These algorithms will ensure real-time optimal operation of a building-integrated CHP system, support electric grid reliability, and lead to achieving the goal of a clean, efficient, reliable and affordable next-generation integrated energy systems. This report lists the components for which PM, real-time CxV and AFDD algorithms will be developed, how the algorithms will be tested, and metrics that will be used to validate the algorithms and easy of deployment. Deployment of these algorithms in the field will result in savings reduction in energy consumption of between 10% and 20%.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Comparison of Supervised and Un-Supervised Machine Learning Algorithms for Threat Detection and Scintillator Performance for Radiation Portal Monitoring

Following the events of September 11, 2001, international border crossing have been equipped with radiation portal monitors (RPMs) to identify illicit radioactive material. Polyvinyl toluene (PVT) scintillators are commonly used due to their low cost and reasonable maintainability, however they offer low spectral resolution. Despite the fact that over twenty years has transpired since this event, radioisotopes are still typically identified by hand-crafted classification algorithms, e.g., total counts or energy windowing, and exhibit relatively poor performance in detecting threats at the low false alarm rates required to support the stream of commerce. While some improvement to performance has been realized via the use of supervised machine learning, these classification algorithms typically utilize simulations in lieu of real data due to the sparsity of data for one or more classes. Accordingly, the performance of these algorithms is somewhat less than optimal when examining experiments or simulations with model mismatch. Consequently, in this work, we examine the application of a number of unsupervised machine learning, anomaly detection based algorithms, to circumvent the inverse crime when analyzing spectroscopy data for RPMs. We also compare anomaly detection results with those obtained via the use of supervised classification detection ML algorithms when model mismatch is introduced between the simulated threat items utilized for training/testing. Finally, we compared the performance of the PVT scintillators to those obtained with higher resolution detectors using both anomaly detection and supervised classification algorithms.

98 NUCLEAR DISARMAMENT, SAFEGUARDS, AND PHYSICAL P↗

Motion Planning Algorithms for Safety and Quantum Computing Efficiency

Motion planning remains a fundamental problem in robotics. Sampling-based algorithms use randomization to allow efficient solutions to this complex problem. As mobile robots and autonomous vehicles become more prevalent in everyday life, motion planning must be applied to increasingly challenging scenarios. Safety has become a paramount concern in motion planning for ensuring robotic applications enrich human lives. To date, many motion planning techniques to increase safety in the face of uncertain and dynamic environments have been developed. This dissertation first addresses distributional safety of Rapidly-Exploring Random Trees (RRT) through our algorithm W-Safe RRT. To acknowledge distributional uncertainty and poor modeling, W-Safe RRT uses the Wasserstein metric to provide a probabilistic bound on the distributional distance between a robot and obstacles. Human-interpretable environmental agent classification allows online safety margin adaptation. We propose and analyze an integrating region method for online classification that increases actor labeling accuracy based on behavioral feature values when compared to state of the art methods. The method performs class assignments based on local maximum likelihood in a created behavioral feature-space, allowing a notion of classification uncertainty. Model-based methods with safety guarantees can quickly become computationally in tractable, especially with multiple agents, higher dimensions, and plentiful unknowns. Sampling based algorithms have been parallelized for computation with multi-core computers and GPUs. We consider the use of quantum algorithms and computers for sampling-based motion planning for the first time. Quantum computing performs operations on superpositions of states and can solve certain problems much more efficiently than classical computers, but introduces previously unseen challenges. With Quantum-RRT, we recast the motion planning problem into a database-search structure and use Quantum Amplitude Amplification to find reachable states in the database with a quadratic performance increase over classical methods. We address two error sources with this method: quantum measurement and quantum oracle errors. We then extend this method to Parallel Quantum-RRT, which uses a manager-worker architecture with multiple parallel quantum workers to increase database search efficiency. We compare algorithm architectures and characterize probabilities of multiple workers finding solutions. Lastly, we test in simulation the quantum algorithms against classical versions in a wide variety of scenarios, concluding that a similar parallelization improvement is to be found in the quantum case as was found in the parallelization of classical RRT.

97 MATHEMATICS AND COMPUTING↗

Revising Apetrei’s bounding volume hierarchy construction algorithm to allow stackless traversal

Stackless traversal is a technique to speed up range queries by avoiding usage of a stack during the tree traversal. One way to achieve that is to transform a given binary tree to store a left child and a skip-connection (also called an escape index). In general, this operation requires an additional tree traversal during the tree construction. For some tree structures, however, it is possible to achieve the same result at a reduced cost. We propose one such algorithm for a GPU hierarchy construction algorithm proposed by Karras in Karras 2012. Furthermore, we show that our algorithm also works with the improved algorithm proposed by Apetrei in Apetrei 2014, despite a different ordering of the internal nodes. We achieve that by modifying Apetrei’s algorithm to restore the original Karras’ ordering of the internal nodes. Using the modified algorithm, we show how to construct a hierarchy suitable for a stackless traversal in a single bottom-up pass.

97 MATHEMATICS AND COMPUTING↗

Application of the Approximate Bayesian Computation Algorithm to Gamma-Ray Spectroscopy

Radioisotope identification (RIID) algorithms for gamma-ray spectroscopy aim to infer what isotopes are present and in what amounts in test items. RIID algorithms either use all energy channels in the analysis region or only energy channels in and near identified peaks. Because many RIID algorithms rely on locating peaks and estimating each peak’s net area, peak location and peak area estimation algorithms continue to be developed for gamma-ray spectroscopy. This paper shows that approximate Bayesian computation (ABC) can be effective for peak location and area estimation. Algorithms to locate peaks can be applied to raw or smoothed data, and among several smoothing options, the iterative bias reduction algorithm (IBR) is recommended; the use of IBR with ABC is shown to potentially reduce uncertainty in peak location estimation. Extracted peak locations and areas can then be used as summary statistics in a new ABC-based RIID. ABC allows for easy experimentation with candidate summary statistics such as goodness-of-fit scores and peak areas that are extracted from relatively high dimensional gamma spectra with photopeaks (1024 or more energy channels) consisting of count rates versus energy for a large number of gamma energies.

Burr, Tom↗

Mapping Geothermal Indicator Minerals Using Fusion of Target Detection Algorithms

Mineral mapping from satellite images provides valuable insights into subsurface mineral alteration for geothermal exploration. In previous studies, eight fundamental algorithms were used for mineral mapping utilizing USGS spectra, a collection of reflectance spectra containing samples of minerals, rocks, and soils created by the USGS. We used an ASD FieldSpec 4 Hi-RES NG portable spectrometer to collect spectra for analyzing ASTER images of the Coso Geothermal Field. Then, we established the ground-truth information and the spectral library by analyzing 97 samples. Samples collected from the field were analyzed using the CSIRO TSG (The Spectral Geologist of the Commonwealth Scientific and Industrial Research Organization). Based on the mineralogy study, multiple high-purity spectra of geothermal alteration minerals were selected from collected data, including alunite, chalcedony, hematite, kaolinite, and opal. Eight mineral spectral target detection algorithms were applied to the preprocessed satellite data with a proposed local spectral library. We measured the highest overall accuracy of 87% for alunite, 95% for opal, 83% for chalcedony, 60% for hematite, and 96% for kaolinite out of these eight algorithms. Three, four, five, and eight algorithms were fused to extract mineral alteration with the obtained target detection results. The results prove that the fusion of algorithms gives better results than using individual ones. In conclusion, this paper discusses the significance of evaluating different mapping algorithms. It proposes a robust fusion approach to extract mineral maps as an indicator for geothermal exploration.

Cavur, Mahmut↗

A Comparison of Void-finding Algorithms Using Crossing Numbers

We study how well void-finding algorithms identify cosmic void regions and whether we can quantitatively and qualitatively compare the voids they find with dynamical information from the underlying matter distribution. Using the ORIGAMI algorithm to determine the number of dimensions along which dark matter particles have undergone shell crossing (crossing number) in N-body simulations from the AbacusSummit simulation suite, we identify dark matter particles that have undergone no shell crossing as belonging to voids. We then find voids in the corresponding halo distribution using two different void-finding algorithms: VoidFinder and V 2 , a ZOBOV-based algorithm. The resulting void catalogs are compared to the distribution of dark matter particles to examine how their crossing numbers depend on void proximity. While both algorithms' voids have a similar distribution of crossing numbers near their centers, we find that beyond 0.25 times the effective void radius, voids found by VoidFinder exhibit a stronger preference for particles with low crossing numbers than those found by V 2 . We examine two possible methods of mitigating this difference in efficacy between the algorithms. While we are able to partially mitigate the ineffectiveness of V 2 by using the distance from the void edge as a measure of centrality, we conclude that VoidFinder more reliably identifies dynamically distinct regions of low crossing number.

79 ASTRONOMY AND ASTROPHYSICS↗

Development and validation of a supervised machine learning radar Doppler spectra peak-finding algorithm

In many types of clouds, multiple hydrometeor populations can be present at the same time and height. Studying the evolution of these different hydrometeors in a time–height perspective can give valuable information on cloud particle composition and microphysical growth processes. However, as a prerequisite, the number of different hydrometeor types in a certain cloud volume needs to be quantified. This can be accomplished using cloud radar Doppler velocity spectra from profiling cloud radars if the different hydrometeor types have sufficiently different terminal fall velocities to produce individual Doppler spectrum peaks. Here we present a newly developed supervised machine learning radar Doppler spectra peak-finding algorithm (named PEAKO). In this approach, three adjustable parameters (spectrum smoothing span, prominence threshold, and minimum peak width at half-height) are varied to obtain the set of parameters which yields the best agreement of user-classified and machine-marked peaks. The algorithm was developed for Ka-band ARM zenith-pointing radar (KAZR) observations obtained in thick snowfall systems during the Atmospheric Radiation Measurement Program (ARM) mobile facility AMF2 deployment at Hyytiälä, Finland, during the Biogenic Aerosols – Effects on Clouds and Climate (BAECC) field campaign. The performance of PEAKO is evaluated by comparing its results to existing Doppler peak-finding algorithms. The new algorithm consistently identifies Doppler spectra peaks and outperforms other algorithms by reducing noise and increasing temporal and height consistency in detected features. In the future, the PEAKO algorithm will be adapted to other cloud radars and other types of clouds consisting of multiple hydrometeors in the same cloud volume.

54 ENVIRONMENTAL SCIENCES↗

Land surface model parameter optimisation using in situ flux data: comparison of gradient-based versus random search algorithms (a case study using ORCHIDEE v1.9.5.2)

Land surface models (LSMs), which form the land component of earth system models, rely on numerous processes for describing carbon, water and energy budgets, often associated with highly uncertain parameters. Data assimilation (DA) is a useful approach for optimising the most critical parameters in order to improve model accuracy and refine future climate predictions. In this study, we compare two different DA methods for optimising the parameters of seven plant functional types (PFTs) of the ORCHIDEE LSM using daily averaged eddy-covariance observations of net ecosystem exchange and latent heat flux at 78 sites across the globe. We perform a technical investigation of two classes of minimisation methods – local gradient-based (the L-BFGS-B algorithm, limited memory Broyden–Fletcher–Goldfarb–Shanno algorithm with bound constraints) and global random search (the genetic algorithm) – by evaluating their relative performance in terms of the model–data fit and the difference in retrieved parameter values. We examine the performance of each method for two cases: when optimising parameters at each site independently (“single-site” approach) and when simultaneously optimising the model at all sites for a given PFT using a common set of parameters (“multi-site” approach). We find that for the single site case the random search algorithm results in lower values of the cost function (i.e. lower model–data root mean square differences) than the gradient-based method; the difference between the two methods is smaller for the multi-site optimisation due to a smoothing of the cost function shape with a greater number of observations. The spread of the cost function, when performing the same tests with 16 random first-guess parameters, is much larger with the gradient-based method, due to the higher likelihood of being trapped in local minima. When using pseudo-observation tests, the genetic algorithm results in a closer approximation of the true posterior parameter value in the L-BFGS-B algorithm. We demonstrate the advantages and challenges of different DA techniques and provide some advice on using it for the LSM parameter optimisation.

58 GEOSCIENCES↗

An Initial Study of the Convergence Rate of Griffin’s Pebble Bed Reactors Algorithm

This paper presents an initial study of the convergence properties of an iterative algorithm for computing the burnup distribution in a pebble bed reactor (PBR) in its equilibrium core condition. The algorithm is implemented in the Griffin code. Griffin is a reactor multiphysics analysis application jointly developed by Idaho National Laboratory (INL) and Argonne National Laboratory (ANL). Griffin’s PBR algorithm is discussed and simulation data are presented. An alternative matrix formulation of the algorithm is presented that facilitates analysis of the iterative algorithm. The dependence of the spectral radius of the iterative algorithm on operational and discretization parameters is investigated.

97 MATHEMATICS AND COMPUTING↗

Implementation and Comparison of Different Algorithms for on the fly Doppler Broadening in RMC Code

Accurate cross sections are of great importance to Monte Carlo particle transport calculation codes which use pointwise cross sections. It is well known that cross sections have much dependence on temperature on account of Doppler effect which is particularly vital for resonance absorption cross sections. In general, pre-prepared continuous-energy libraries are used in Monte Carlo codes, which is feasible in many applications. However, in multi-physics calculations where neutronics and thermal hydraulics are coupled, cross sections at a fine interval of temperatures are desired, which brings a great challenge to computer memory. Consequently, different methods about on the fly Doppler broadening for cross sections are proposed, which can generate cross sections at the specific temperature points during neutron simulations. These methods can be roughly classified into two categories: one is to calculate the required cross sections by different algorithms, such as interpolation using a high order function expansion, multipole representation, and different integration algorithms based on Doppler broadening equation. The other, for instance, target motion sampling (TMS), does not calculate the Doppler broadening cross sections but takes into account Doppler effect by rejection technique. In this paper, several on the fly Doppler broadening algorithms based on Doppler broadening equation are implemented in the Reactor Monte Carlo code RMC, and then the accuracy and efficiency are discussed and compared. In this paper, several algorithms for on the fly Doppler broadening based on Doppler broadening equation have been implemented in RMC and the focus falls on the comparison of the Gauss Legendre quadrature and Gauss Hermite quadrature. Gauss Legendre quadrature is more accurate than Gauss Hermite quadrature but also more time consuming. Base temperature has a significant impact on Gauss Hermite quadrature while increasing base temperature to room temperature (300 K) can give satisfactory results. In addition, the proportion of overhead of Doppler broadening treatment in total computational time tends to decrease with an increase number of nuclides in fuel. For depletion calculation, both algorithms are in good agreement with reference and the relative errors of K{sub inf} are within 5 times of standard deviation. As for total computational time, the ratio between Gauss Legendre quadrature or Gauss Hermite quadrature and reference decreases and reaches 9.6 or 3.4 at last, respectively. Four important isotopes are chosen to compare the atom density and all relative errors are within 0.25%. After comparisons of different algorithms and different base temperatures, it can be found that Gauss Hermite quadrature broadening from 300 K can perform on the fly cross section Doppler broadening with least total computational time and acceptable precision. (authors)

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Assessment of Uncertainty in Cloud Radiative Effects and Heating Rates through Retrieval Algorithm Differences: Analysis using 3-years of ARM data at Darwin, Australia

Ground-based radar and lidar observations obtained at the Department of Energy’s Atmospheric Radiation Measurement Program’s Tropical Western Pacific site located in Darwin, Australia are used to retrieve ice cloud properties in anvil and cirrus clouds. Cloud microphysical properties derived from four different retrieval algorithms (two radar-lidar and two radar only algorithms) are compared by examining mean profiles and probability density functions of effective radius (Re), ice water content (IWC), extinction, ice number concentration, ice crystal fall speed, and vertical air velocity. Retrieval algorithm uncertainty is quantified using radiative flux closure exercises. The effect of uncertainty in retrieved quantities on the cloud radiative effect and radiative heating rates are presented. Our analysis shows that IWC compares well among algorithms, but Re shows significant discrepancies, which is attributed primarily to assumptions of particle shape. Uncertainty in Re and IWC translates into sometimes-large differences in cloud radiative effect (CRE) though the majority of cases have a CRE difference of roughly 10 W m-2 on average. These differences, which we believe are primarily driven by the uncertainty in Re, can cause up to 2 K/day difference in the radiative heating rates between algorithms.

algorithm↗

Performance of biologically inspired algorithms tuned on TiO 2 nanoparticle benchmark system

Biologically inspired optimization algorithms (BIOA), such as particle swarm optimization (PSO) and differential evolution (DE), are often applied to a specific problem with the tacit assumptions that each algorithm will have a unique set of “ideal” tuning parameters that provide “best” performance, and that, once tuned, two different optimization algorithms ought to exhibit distinct performance. This work tests those assumptions by systematically comparing PSO and DE applied to identify stable and metastable configurations of a benchmark system, a titania dimer Ti 2 O 4 , whose energy is described by a modified Matsui-Akaogi pairwise potential. The hypotheses (H) are formally expressed as: (H1) for both PSO and DE there exists a unique, optimal set of tuning parameters that maximize its performance on a given problem; (H2) when running two different BIOAs, one algorithm must demonstrate superior performance over the other. By identifying and studying an approximate Pareto-optimal set of tuning parameters for DE and PSO, H1 is shown to be strictly false for DE, and tentatively false for PSO, while H2 is shown to be false with respect to certain statistics. Here, we further investigate the correlations between key tuning parameters and algorithm performance. Our conclusion may be implemented to further optimize and develop BIOAs applied to materials systems.

36 MATERIALS SCIENCE↗

Parallel Randomized Tucker Decomposition Algorithms

The Tucker tensor decomposition is a natural extension of the singular value decomposition (SVD) to multiway data. Here, we propose to accelerate Tucker tensor decomposition algorithms by using randomization and parallelization. We present two algorithms that scale to large data and many processors, significantly reduce both computation and communication cost compared to previous deterministic and randomized approaches, and obtain nearly the same approximation errors. The key idea in our algorithms is to perform randomized sketches with Kronecker-structured random matrices, which reduces computation compared to unstructured matrices and can be implemented using a fundamental tensor computational kernel. We provide probabilistic error analysis of our algorithms and implement a new parallel algorithm for the structured randomized sketch. Our experimental results demonstrate that our combination of randomization and parallelization achieves accurate Tucker decompositions much faster than alternative approaches. We observe up to a 16X speedup over the fastest deterministic parallel implementation on 3D simulation data.

Tucker decompositions↗

A Generalized Backward Euler algorithm for the numerical integration of a viscous breakage model

This paper discusses the formulation and the numerical performance of a fully implicit algorithm used to integrate a rate-dependent model defined within a breakage mechanics framework. For this purpose, a Generalized Backward Euler (GBE) algorithm has been implemented according to two different linearization strategies: The former is derived by a direct linearization of the constitutive equations, while the latter introduces rate effects through a consistency parameter. Additionally, the accuracy and efficiency of the GBE algorithm have been investigated by (1) performing material point analyses and (2) solving initial boundary value problems. In both cases, the overall performance of the underlying algorithm is inspected for a range of loading rates, thus simulating comminution from slow to fast dynamic problems. As the viscous response of the breakage model can be recast through a viscous nucleus function, the presented algorithm can be considered as a general framework to integrate constitutive equations relying on the overstress approach typical of Perzyna-like viscoplastic models.

36 MATERIALS SCIENCE↗

On the development of protein pKa calculation algorithms

Protein pKa calculation algorithms are typically developed to reproduce experimental pKa values and provide us with a better understanding of the fundamental importance of electrostatics for protein structure and function. However, the approximations and adjustable parameters employed in almost all pKa calculation methods means that there is the risk that pKa calculation algorithms are 'over-fitted' to the available datasets, and that these methods therefore do not model protein physics realistically. We employ simulations of the protein pKa calculation algorithm development process to show that careful optimization procedures and non-biased experimental datasets must be applied to ensure a realistic description of the underlying physical terms. We furthermore investigate the effect of experimental noise and find a significant effect on the pKa calculation algorithm optimization landscape. Finally, we comment on strategies for ensuring the physical realism of protein pKa calculation algorithms and we assess the overall state of the field with a view to predicting future directions of development.

59 BASIC BIOLOGICAL SCIENCES↗

Preprocessing Prediction of Advanced Algorithms for Medical Imaging

Advanced medical imaging algorithms (such as bone removal, vessel segmentation, or a lung nodule detection) can provide extremely valuable information to the radiologists, but they might sometimes be very time consuming. Being able to run the algorithms in advance can be a possible solution. However, we do not know which algorithm to run on a given dataset before it is actually used. It is possible to manually insert matching rules for preprocessing algorithms, but it requires high maintenance and does not work well in practice. This paper presents a dynamic machine learning solution for predicting which advanced visualization (AV) algorithm needs to be applied on a given series. The system gets a handful of free text DICOM tags as an input and builds a model in the clinical setting. It incorporates a Bag of Words (BOW) feature extractor and a Random Forest classifier. The approach was tested on two datasets from clinical sites which use different languages and varying scanner models. We show that even without feature extraction, sensitivity of above 90% can be reached on both of them. By using BOW feature extractor, precision and sensitivity can usually be further improved. Even on a noisy and highly unbalanced dataset, only around 100 samples were needed to reach sensitivity of above 80% and specificity of above 97%. We show how the solution can be part of a Smart Preprocessing mechanism in a viewing software. Using such a system will ultimately minimize the time to launch studies and improve radiologists reading time efficiency.

62 RADIOLOGY AND NUCLEAR MEDICINE↗

Application of Noise Cancelling and Damage Detection Algorithms in NDE of Concrete Bridge Decks Using Impact Signals

Delamination is a commonly observed distress in concrete bridge decks. Among all the delamination detection methods, acoustic methods have the advantages of being fast and inexpensive. In traditional acoustic inspection methods, the inspector drags a chain along or hammers on the bridge deck and detects delamination from the 'hollowness' of the sounds. The signals are often contaminated by ambient traffic noise and the detection of delamination is highly subjective. This paper describes the performance of an impact-bases acoustic NDE method where the traffic noise was filtered by employing a noise cancelling algorithm and where subjectivity was eliminated by introducing feature extraction and pattern recognition algorithms. Different algorithms were compared and the best one was selected in each category. The comparison showed that the modified independent component analysis (ICA) algorithm was most effective in cancelling the traffic noise and features consisting of mel-frequency cepstral coefficients (MFCCs) had the best performance in terms of repeatability and separabillty. The condition of the bridge deck was then detected by a radial basis function (RBF) neural network. The performance of the system was evaluated using both experimental and field data. The results show that the selected algorithms increase the noise robustness of acoustic methods and perform satisfactorily if the training data is representative.

42 ENGINEERING↗