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At least 1,333 records · Page 74

Reflected solar radiances from broken cloud scenes and the interpretation of scanner measurements

If an adequate model of the reflection characteristics of a given scene is available, the reflected solar irradiance from the scene may be determined from radiance measurements made by satellite-borne scanning radiometers. A theoretical analysis of the reflection functions of broken cloud scenes is presented, using Monte Carlo simulations of the radiative transfer in various three-dimensional geometries. It is shown that the reflection functions of horizontally extensive (stratiform) and horizontally limited (cumuliform) clouds are generally quite different. The differences are greatest for nadir and limb views, but tend to vanish for reflected radiances with a zenith angle of 60 deg. Applications to satellite observations suggest potential errors of a factor of 2 in the inferred irradiance are likely due to scene misidentification when the radiances are interpreted indiscriminantly. Selection of preferred satellite viewing directions, however, can significantly reduce this error.

Davies, R.↗

Rapid X-ray spectral variability in NGC 3227

We present preliminary results of an ASCA observation of the Seyfert 1 galaxy, NGC 3227. The source exhibits rapid X-ray amplitude and spectral variability, the flux below 2 keV varying by a factor of approximately 3 in approximately 10,000 s while the flux in the 2-10 keV band varies by a factor of approximately 2 in the same interval. The spectrum below approximately 1 keV shows complex structure compared to a simple power-law model. We argue that the simplest interpretation of the spectrum is in terms of a power-law continuum modified by absorption in a photoionized medium. Simple, static, ionized absorber models yield an ionization parameter of approximately 0.05 and column density approximately 3.6 x 10(exp 21)/sq cm. However, the data strongly indicate that the situation is much more complex than this. If the spectral variability is caused by a changing ionization state of the absorber, then both the ionization state and column density are required to decrease as the intrinsic source luminosity increases. This does not have a simple physical interpretation. On the other hand, the data are also consistent with the spectral variability being due to changes in the intrinsic power-law index with little change in the ionization state of the absorber. This case could correspond to an absorber which is always in some average ionization state and the continuum variability is too fast for the absorber to deviate significantly from that, or the absorber could be in the form of an X-ray-heated wind.

Ptak, A.↗

The Physics of Accretion in X-Ray Binaries

This project consists of several related investigations directed to the study of mass transfer processes in X-ray binaries. Models developed over several years incorporating highly detailed physics will be tested on a balanced mix of existing data and planned observations with both ground and space-based observatories. The extended time coverage of the observations and the existence of simultaneous X-ray, ultraviolet, and optical observations will be particularly beneficial for studying the accretion flows. These investigations, which take as detailed a look at the accretion process in X-ray binaries as is now possible, test current models to their limits, and force us to extend them. We now have the ability to do simultaneous ultraviolet/X-ray/optical spectroscopy with HST, Chandra, XMM, and ground-based observatories. The rich spectroscopy that these observations give us must be interpreted principally by reference to detailed models, the development of which is already well underway; tests of these essential interpretive tools are an important product of the proposed investigations.

Vrtilek, S.↗

The Physics of Accretion in X-Ray Binaries

This project consists of several related investigations directed to the study of mass transfer processes in X-ray binaries. Models developed over several years be tested on a balanced mix of existing data and planned observations with both ground and space-based observatories. The extended time coverage of the observations and the existence of simultaneous X-ray, ultraviolet, and optical observations will be particularly beneficial for studying the accretion flows. These investigations, which take as detailed a look at the accretion process in X-ray binaries as is now possible, test current models to their limits, and force us to extend them. We now have the ability to do simultaneous ultraviolet/X-ray/optical spectroscopy with HST, Chandra, XMM, and ground-based observatories. The rich spectroscopy that these observations give us must be interpreted principally by reference to detailed models, the development of which is already well underway; tests of these essential interpretive tools are an important product of the proposed investigations.

Oliversen, Ronald↗

Physics of Accretion in X-Ray Binaries

This project consists of several related investigations directed to the study of mass transfer processes in X-ray binaries. Models developed over several years incorporating highly detailed physics will be tested on a balanced mix of existing data and planned observations with both ground and space-based observatories. The extended time coverage of the observations and the existence of {\it simultaneous} X-ray, ultraviolet, and optical observations will be particularly beneficial for studying the accretion flows. These investigations, which take as detailed a look at the accretion process in X-ray binaries as is now possible, test current models to their limits, and force us to extend them. We now have the ability to do simultaneous ultraviolet/X-ray/optical spectroscopy with HST, Chandra, XMM, and ground-based observatories. The rich spectroscopy that these Observations give us must be interpreted principally by reference to detailed models, the development of which is already well underway; tests of these essential interpretive tools are an important product of the proposed investigations.

Vrtilek, Saeqa D.↗

Leveraging interpolation models and error bounds for verifiable scientific machine learning

Effective verification and validation techniques for modern scientific machine learning workflows are challenging to devise. Statistical methods are abundant and easily deployed, but often rely on speculative assumptions about the data and methods involved. Error bounds for classical interpolation techniques can provide mathematically rigorous estimates of accuracy, but often are difficult or impractical to determine computationally. Here, in this work, we present a best-of-both-worlds approach to verifiable scientific machine learning by demonstrating that (1) multiple standard interpolation techniques have informative error bounds that can be computed or estimated efficiently; (2) comparative performance among distinct interpolants can aid in validation goals; (3) deploying interpolation methods on latent spaces generated by deep learning techniques enables some interpretability for black-box models. We present a detailed case study of our approach for predicting lift-drag ratios from airfoil images. Code developed for this work is available in a public Github repository.

97 MATHEMATICS AND COMPUTING↗

Flux Comparison of Master-8 And Ordem 3.1 Modelled Space Debris Population

In this paper, the modelled debris fluxes by ESA’s Meteoroid And Space debris Terrestrial Environment Reference (MASTER-8) model and NASA’s Orbital Debris Engineering Model (ORDEM) 3.1 are compared. At first, the basic modelling approaches for both models are presented to explain the fundamentally different model philosophies and help the reader to comprehend and interpret the obtained results. Then, the flux results of both models for three different orbits are presented and analysed. They are discussed and set into perspective. A conclusion is drawn at the end of the paper, highlighting the ongoing cooperation of both agencies responsible for their models.

Andre Horstmann↗

Integrating AlphaFold and deep learning for atomistic interpretation of cryo-EM maps

Abstract Interpretation of cryo-electron microscopy (cryo-EM) maps requires building and fitting 3D atomic models of biological molecules. AlphaFold-predicted models generate initial 3D coordinates; however, model inaccuracy and conformational heterogeneity often necessitate labor-intensive manual model building and fitting into cryo-EM maps. In this work, we designed a protein model-building workflow, which combines a deep-learning cryo-EM map feature enhancement tool, CryoFEM (Cryo-EM Feature Enhancement Model) and AlphaFold. A benchmark test using 36 cryo-EM maps shows that CryoFEM achieves state-of-the-art performance in optimizing the Fourier Shell Correlations between the maps and the ground truth models. Furthermore, in a subset of 17 datasets where the initial AlphaFold predictions are less accurate, the workflow significantly improves their model accuracy. Our work demonstrates that the integration of modern deep learning image enhancement and AlphaFold may lead to automated model building and fitting for the atomistic interpretation of cryo-EM maps.

59 BASIC BIOLOGICAL SCIENCES↗

Remote Sensing Information Science Research

This document is the final report summarizing research conducted by the Remote Sensing Research Unit, Department of Geography, University of California, Santa Barbara under National Aeronautics and Space Administration Research Grant NAG5-10457. This document describes work performed during the period of 1 March 2001 thorough 30 September 2002. This report includes a survey of research proposed and performed within RSRU and the UCSB Geography Department during the past 25 years. A broad suite of RSRU research conducted under NAG5-10457 is also described under themes of Applied Research Activities and Information Science Research. This research includes: 1. NASA ESA Research Grant Performance Metrics Reporting. 2. Global Data Set Thematic Accuracy Analysis. 3. ISCGM/Global Map Project Support. 4. Cooperative International Activities. 5. User Model Study of Global Environmental Data Sets. 6. Global Spatial Data Infrastructure. 7. CIESIN Collaboration. 8. On the Value of Coordinating Landsat Operations. 10. The California Marine Protected Areas Database: Compilation and Accuracy Issues. 11. Assessing Landslide Hazard Over a 130-Year Period for La Conchita, California Remote Sensing and Spatial Metrics for Applied Urban Area Analysis, including: (1) IKONOS Data Processing for Urban Analysis. (2) Image Segmentation and Object Oriented Classification. (3) Spectral Properties of Urban Materials. (4) Spatial Scale in Urban Mapping. (5) Variable Scale Spatial and Temporal Urban Growth Signatures. (6) Interpretation and Verification of SLEUTH Modeling Results. (7) Spatial Land Cover Pattern Analysis for Representing Urban Land Use and Socioeconomic Structures. 12. Colorado River Flood Plain Remote Sensing Study Support. 13. African Rainfall Modeling and Assessment. 14. Remote Sensing and GIS Integration.

Clarke, Keith C.↗

From disorganized data to emergent dynamic models: Questionnaires to partial differential equations

Starting with sets of disorganized observations of spatially varying and temporally evolving systems, obtained at different (also disorganized) sets of parameters, we demonstrate the data-driven derivation of parameter dependent, evolutionary partial differential equation (PDE) models capable of generating the data. This tensor type of data is reminiscent of shuffled (multidimensional) puzzle tiles. The independent variables for the evolution equations (their “space” and “time”) as well as their effective parameters are all emergent , i.e. determined in a data-driven way from our disorganized observations of behavior in them. We use a diffusion map based questionnaire approach to build a smooth parametrization of our emergent space/time/parameter space for the data. This approach iteratively processes the data by successively observing them on the “space,” the “time” and the “parameter” axes of a tensor. Once the data become organized, we use machine learning (here, neural networks) to approximate the operators governing the evolution equations in this emergent space. Our illustrative examples are based (i) on a simple advection–diffusion model; (ii) on a previously developed vertex-plus-signaling model of Drosophila embryonic development; and (iii) on two complex dynamic network models (one neuronal and one coupled oscillator model) for which no obvious smooth embedding geometry is known a priori. This allows us to discuss features of the process like symmetry breaking, translational invariance, and autonomousness of the emergent PDE model, as well as its interpretability.

generative models↗

On the meaning of Berry force for unrestricted systems treated with mean-field electronic structure

We show that the Berry force as computed by an approximate, mean-field electronic structure can be meaningful if properly interpreted. In particular, for a model Hamiltonian representing a molecular system with an even number of electrons interacting via a two-body (Hubbard) interaction and a spin–orbit coupling, we show that a meaningful nonzero Berry force emerges whenever there is spin unrestriction—even though the Hamiltonian is real-valued and formally the on-diagonal single-surface Berry force must be zero. Moreover, if properly applied, this mean-field Berry force yields roughly the correct asymptotic motion for scattering through an avoided crossing. That being said, within the context of a ground-state calculation, several nuances do arise as far interpreting the Berry force correctly, and as a practical matter, the Berry force diverges near the Coulson–Fischer point (which can lead to numerical instabilities). Here, we do not address magnetic fields here.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DFT-Based Calculation of Dissolution Activation Energy and Kinetics of Ni–Cr Alloys

A density functional theory investigation of the process of dissolution of Ni and Cr adatoms from model Ni–Cr(111) alloy surfaces is presented, both in vacuum and with explicit water molecules. The goal is to understand how the electronic structures solved using DFT can provide insights as to changes in valence, energy and coordination of the adatoms in the process of dissolving from the alloy surface. It is found that nearby Cr solute atoms increase the dissolution activation energy of Ni. Cr adatoms have a similar dissolution activation energy as Ni adatoms, except for one particular surface configuration that has a much smaller dissolution activation energy, which might promote selective dissolution of Cr in Ni–Cr alloys. To interpret the first-principles modeling results for the potential energy trajectory along the dissolution reaction coordinate, we provide a thermodynamic breakdown of the various terms that contribute to the dissolution activation and total reaction energy. The role of addition of Cr is explored on the dissolution kinetics of a Ni–Cr alloys of varying composition by constructing a model for the corrosion current density with DFT-based activation energies. Lastly, dissolution resistance index is proposed as a quantifiable descriptor of the dissolution resistance of corrosion resistant alloys.

36 MATERIALS SCIENCE↗

Combined searches for the production of supersymmetric top quark partners in proton–proton collisions at $\sqrt{s} = 13\,\text {Te}\text {V} $

A combination of searches for top squark pair production using proton–proton collision data at a center-of-mass energy of 13$\,\text {Te}\text {V}$ at the CERN LHC, corresponding to an integrated luminosity of 137$\,\text {fb}^{-1}$ collected by the CMS experiment, is presented. Signatures with at least 2 jets and large missing transverse momentum are categorized into events with 0, 1, or 2 leptons. New results for regions of parameter space where the kinematical properties of top squark pair production and top quark pair production are very similar are presented. Depending on the model, the combined result excludes a top squark mass up to 1325$\,\text {Ge}\text {V}$ for a massless neutralino, and a neutralino mass up to 700$\,\text {Ge}\text {V}$ for a top squark mass of 1150$\,\text {Ge}\text {V}$. Top squarks with masses from 145 to 295$\,\text {Ge}\text {V}$, for neutralino masses from 0 to 100$\,\text {Ge}\text {V}$, with a mass difference between the top squark and the neutralino in a window of 30$\,\text {Ge}\text {V}$ around the mass of the top quark, are excluded for the first time with CMS data. The results of theses searches are also interpreted in an alternative signal model of dark matter production via a spin-0 mediator in association with a top quark pair. Upper limits are set on the cross section for mediator particle masses of up to 420$\,\text {Ge}\text {V}$.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Search for dark matter in association with an energetic photon in pp collisions at $ \sqrt{s} $ = 13 TeV with the ATLAS detector

A search for dark matter is conducted in final states containing a photon and missing transverse momentum in proton-proton collisions at s√ = 13 TeV. The data, collected during 2015–2018 by the ATLAS experiment at the CERN LHC, correspond to an integrated luminosity of 139 fb -1 . No deviations from the predictions of the Standard Model are observed and 95% confidence-level upper limits between 2.45 fb and 0.5 fb are set on the visible cross section for contributions from physics beyond the Standard Model, in different ranges of the missing transverse momentum. The results are interpreted as 95% confidence-level limits in models where weakly interacting dark-matter candidates are pair-produced via an s-channel axial-vector or vector mediator. Dark-matter candidates with masses up to 415 (580) GeV are excluded for axial-vector (vector) mediators, while the maximum excluded mass of the mediator is 1460 (1470) GeV. In addition, the results are expressed in terms of 95% confidence-level limits on the parameters of a model with an axion-like particle produced in association with a photon, and are used to constrain the coupling g a Z γ of an axion-like particle to the electroweak gauge bosons.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Search for heavy Majorana neutrinos in e ± e ± and e ± μ ± final states via WW scattering in pp collisions at s = 13 TeV with the ATLAS detector

A search for heavy Majorana neutrinos in scattering of same-sign W boson pairs in proton–proton collisions at $\sqrt{s}$ = 13 TeV at the LHC is reported. The dataset used corresponds to an integrated luminosity of 140 fb -1 , collected with the ATLAS detector during 2015–2018. The search is performed in final states including a same-sign ee or eμ pair and at least two jets with large invariant mass and a large rapidity difference. No significant excess of events with respect to the Standard Model background predictions is observed. The results are interpreted in a benchmark scenario of the Phenomenological Type-I Seesaw model. New constraints are set on the values of the |V eN | 2 and |V eN V$^{*}_{μN}$| parameters for heavy Majorana neutrino masses between 50 GeV and 20 TeV, where V ℓN is the matrix element describing the mixing of the heavy Majorana neutrino mass eigenstate with the Standard Model neutrino of flavour ℓ = e,μ. The sensitivity to the Weinberg operator is investigated and constraints on the effective ee and eμ Majorana neutrino masses are reported. The statistical combination of the ee and eμ channels with the previously published μμ channel is performed.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Charged Wellbore Casing Controlled Source Electromagnetics (CWC-CSEM) for Reservoir Imaging and Monitoring (Final report)

This project addresses the needs of the U.S. Department of Energy (DOE) to develop advanced monitoring technologies and protocols to track the fate of subsurface carbon dioxide (CO2) plumes for carbon storage. Specifically, the project seeks to develop and test a unique and novel system of technologies consisting of electromagnetic data acquisition, coupled multiphysics imaging, and reservoir model enhancement to understand the migration and long-term distribution of CO2 in the subsurface. The overarching objective is to develop an integrated approach for long term monitoring of carbon storage. The two main components of the project include the methodology development and the test of the method at a field site. The methodology component consists of 1) developing the field procedure and protocol for collecting time-lapse controlled-source electromagnetic (CSEM) data with source electric current injected into the subsurface through wellbore casings; 2) building of background 3D electrical conductivity utilizing multiple sources of data such as supplemental surface transient EM (TEM) surveys, well-logs, and seismic structural information, for enhancing CSEM signal from reservoir depths; and 3) coupled multiphysics simulations and inversion of CSEM data constrained by production data and by structural information from seismic imaging of the reservoir and overlying formations. The testing component used the field site of Bell Creek Oil Field, which served both as a field laboratory for the method development as well as a test site to evaluate the CSEM signal strengths and the methodology developed in this research project. We have accomplished all the proposed tasks and developed the methodology as planned. These include the procedure for time-lapse CSEM data acquisition, data processing techniques, integration with 3D conductivity model building, fast reservoir simulation for history matching using machine learning, and interpreting CSEM data with coupling to the reservoir modeling. Collectively, the outcome of these tasks form a coherent workflow that can be applied to monitor dedicated carbon storage in saline reservoirs. The testing component evaluated the applicability and limitations of the method, and concluded that the method would be ideal for monitoring dedicated carbon storage sites utilizing saline reservoirs.

54 ENVIRONMENTAL SCIENCES↗