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DTSTART;TZID=America/Detroit:20180208T140000
DTEND;TZID=America/Detroit:20180208T150000
DTSTAMP:20260604T032813
CREATED:20230905T171417Z
LAST-MODIFIED:20230905T171417Z
UID:10000097-1518098400-1518102000@micde.umich.edu
SUMMARY:MICDE Seminar: Dominika Zgid\, Chemistry\, University of Michigan
DESCRIPTION:Bio: Dominika Zgid is an assistant professor of Chemistry at the University of Michigan. She received her Ph.D. from the University of Waterloo\, Canada\, in 2008. Since starting at Michigan\, she has received a DOE Early Career Award in 2013 and an NSF Career Award in 2015. \nHer main interests are at the interface of theoretical chemistry and condensed matter physics with a major focus on designing new\, systematically improvable and controlled computational methods that can be used to study strongly correlated molecules and materials. She has worked on a variety of topics\, such as a molecular version of density matrix renormalization group\, solvers for dynamical mean field theory using explicit bath formulation\, conserving Green’s function methods for weakly correlated systems and the development of the self-energy embedding theory. \nTowards Accurate Quantum-Mechanical Calculations beyond Density Functional Theory on Large Systems\nWe present a detailed discussion of self-energy embedding theory (SEET) which is a quantum embedding scheme allowing us to describe a chosen subsystem very accurately while keeping the description of the environment at a lower cost. We apply SEET to molecular examples where commonly our chosen subsystem is made out of a set of strongly correlated orbitals while the weakly correlated orbitals constitute an environment. Such a self-energy separation is very general and to make this procedure applicable to multiple systems a detailed and practical procedure for the evaluation of the system and environment self-energy is necessary. We list all the intricacies for one of the possible procedures while focusing our discussion on many practical implementation aspects such as the choice of best orbital basis\, impurity solver\, and many steps necessary to reach chemical accuracy. \nFinally\, on a set of carefully chosen molecular examples\, we demonstrate that SEET\, which is a controlled\, systematically improvable Green’s function method can be as accurate as established wavefunction quantum chemistry methods.
URL:https://micde.umich.edu/event/micde-seminar-dominika-zgid-chemistry-university-of-michigan/
LOCATION:CHEM 1706\, 930 N University\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:Featured Events,MICDE Seminar Series
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END:VEVENT
BEGIN:VEVENT
DTSTART;TZID=America/Detroit:20180124T150000
DTEND;TZID=America/Detroit:20180124T160000
DTSTAMP:20260604T032813
CREATED:20230905T171417Z
LAST-MODIFIED:20260525T001342Z
UID:10000104-1516806000-1516809600@micde.umich.edu
SUMMARY:MICDE Seminar: Jesse Capecelatro\, Department of Mechanical Engineering\, University of Michigan
DESCRIPTION:Bio: Professor Capecelatro is interested in developing large-scale simulation capabilities for prediction and design of the complex multi-physics and multiphase flows relevant to energy and the environment. To achieve this\, his group develops robust and scalable numerical methods to leverage world-class supercomputing resources. His current research projects are focused on adjoint-based methods applied to turbulent combustion\, modeling strongly-coupled particle-laden flows\, and understanding interactions between electrostatics and turbulence in atmospheric clouds. \nPrior to joining the mechanical engineering department at the University of Michigan in 2016\, Dr. Capecelatro was a research scientist at the Center for Exascale Simulation of Plasma-coupled Combustion (XPACC) at the University of Illinois Urbana-Champaign. He received a B.S. in mechanical engineering from SUNY Binghamton in 2009\, and two years later completed a M.S. in mechanical engineering from the University of Colorado Boulder\, where he performed research in collaboration with the National Renewable Energy Laboratory on numerical modeling of fluidized bed reactors. In 2014 he received a Ph.D. from Cornell University under the guidance of Prof Olivier Desjardins\, where his thesis focused on high performance computing of turbulent multiphase flows. He spent the summer following his Ph.D. as a visiting postdoc at the Institut de Mécanique des Fluides de Toulouse and École Centrale Paris focusing on fundamental and numerical studies of particle-induced turbulence. \nTowards Accurate and Tractable Methods of Disperse Multiphase Flows in Extreme Environments\nThe complex and multiscale behavior associated with turbulent flows is further complicated by the presence of a disperse phase (i.e.\, solid particles\, liquid drops\, or gaseous bubbles). Strong coupling between the disperse phase and underlying turbulence plays important roles across engineering and science. For example\, liquid sprays are often used during rocket launches to suppress undesirable aeroacoustic loading on the fuselage and nearby equipment. Recent experiments have shown that water sound suppression systems might also be a viable option for jet noise reduction during take-off and landing of high-performance aircrafts. Within the energy sector\, turbulent suspensions of catalytic particles are used in a variety of energy conversion technologies\, yet the multiphase dynamics occurring in these reactors remain largely unknown. A key challenge in understanding and predicting turbulent multiphase flows is the fundamental importance of processes occurring on extremely small scales that ultimately influence the macroscopic behavior. This presentation will provide an overview of recent advancements in numerical modeling of particle-laden flows with several applications of ongoing research projects.
URL:https://micde.umich.edu/event/micde-seminar-jesse-capecelatro-department-of-mechanical-engineering-university-of-michigan/
LOCATION:185 EWR\, 1351 Beal Ave\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:Featured Events,MICDE Seminar Series
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2017/09/Jesse-Capecelatro.png
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X-APPLE-STRUCTURED-LOCATION;VALUE=URI;X-ADDRESS=185 EWR 1351 Beal Ave Ann Arbor MI 48109 United States;X-APPLE-RADIUS=500;X-TITLE=1351 Beal Ave:geo:-83.7132928,42.2927609
END:VEVENT
BEGIN:VEVENT
DTSTART;TZID=America/Detroit:20180116T160000
DTEND;TZID=America/Detroit:20180116T170000
DTSTAMP:20260604T032813
CREATED:20230905T171416Z
LAST-MODIFIED:20230905T171416Z
UID:10000098-1516118400-1516122000@micde.umich.edu
SUMMARY:MICDE Seminar: Theresa Windus\, Chemistry\, Iowa State University
DESCRIPTION:Bio: Theresa Windus is a professor of Chemistry at Iowa State University. She earned her Ph.D. from Iowa State University in 1993 and did post-doctoral research at Northwestern University. Theresa was also the Director of Computational Chemistry/Training at Ohio Supercomputer Center and the Computational Chemistry lead at the Wright Patterson Air Force Base Major Shared Resource Center. Most recently\, she was the manager of the Molecular Science Software Group and the Visualization and User Services group in the Molecular Science Computing Facility in the Environmental Molecular Sciences Laboratory of Pacific Northwest National Laboratory. \nThe challenges of the exascale from the view of a molecular chemist\nThis talk will focus on the challenges that computational chemistry faces in taking the equations that model the very small (molecules and the reactions they undergo) to efficient and scalable implementations on the very large computers of today andtomorrow. In particular\, how do we take advantage of the newest architectures while preparing for the next generation of computers? How do we increase programmer productivity while ensuring excellent performance\, efficiency and portability across multiple platforms? How do we take advantage of the work of mathematicians\, computer scientists and other computational scientists to enable our science\, while ensuring maintainability and usability of the software? How do we ensure that the algorithms that we develop are making wise use of the computational resources? How do help the next generation of computational chemists to be ready for the complex computing environments that they will face? While not claiming to have answers to all (or any!) of these questions\, we will explore some possible solutions and their implications as we go forward and face the current petascale and the future exascale challenges. These will be in the context of several Department of Energy funded computational chemistry Exascale Computing Projects (NWChemEx and GAMESS) and the NSF funded Molecular Sciences Software Institute. \nProf. Windus is being hosted by Prof. Geva (Chemistry). If you would like to meet with him Prof. Windus during her visit please email mcteja@umich.edu
URL:https://micde.umich.edu/event/micde-seminar-theresa-windus-chemistry-iowa-state-university/
LOCATION:CHEM 1640\, 930 N University\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:Featured Events,MICDE Seminar Series,Seminar
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GEO:42.2780183;-83.7370191
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END:VEVENT
BEGIN:VEVENT
DTSTART;TZID=America/Detroit:20171205T150000
DTEND;TZID=America/Detroit:20171205T160000
DTSTAMP:20260604T032813
CREATED:20230905T171416Z
LAST-MODIFIED:20230905T171416Z
UID:10000093-1512486000-1512489600@micde.umich.edu
SUMMARY:MICDE Seminar: Tarek Zohdi\, Department of Mechanical Engineering\, University of California\, Berkeley
DESCRIPTION:Bio: Tarek I. Zohdi received his Ph.D. in 1997 in Computational and Applied Mathematics from the University of Texas at Austin and his Habilitation in General Mechanics from the Gottfried Leibniz University of Hannover in 2002. He is currently a Chancellor’s Professor of Mechanical Engineering\, Chair of the Computational and Data Science and Engineering Program at UC Berkeley and holder of the W. C. Hall Family Endowed Chair in Engineering. He also holds a Staff Scientist position at Lawrence Berkeley National Labs. His main research interests are in computational approaches for advanced manufacturing and nonconvex multiscale-multiphysics inverse problems\, in particular addressing the issue of how large numbers of micro-constituents interact to produce macroscale aggregate material behavior. He has published over 145 archival refereed journal papers and five books. In 2000\, he received the Zienkiewicz Prize and Medal\, which are awarded once every two years\, to one post-graduate researcher under the age of 35\, by The Institution of Civil Engineers in London\, to commemorate the work of Professor O. C. Zienkiewicz\, for research which contributes most to the field of numerical methods in engineering. In 2002\, he received the Best Paper of the Year 2001 Award in London\, at the Lord’s Cricket Grounds\, for a paper published in Engineering Computations\, pertaining to modeling and simulation of the propagation of failure in particulate aggregates of material. In 2003\, he received the Junior Achievement Award of the American Academy of Mechanics. The award is given once a year\, to one post-graduate researcher\, to recognize outstanding research during the first decade of a professional career. In 2008\, he was elected Fellow of the International Association for Computational Mechanics (IACM) and in 2009 he was elected Fellow of the United Stated Association for Computational Mechanics (USACM). He was elected President of the USACM in 2012\, and served from 2012 to 2014. He is an editor of Computational Mechanics\, Editor in Chief of Computational Particle Mechanics and serves on 12 editorial boards of international journals. For more information visit http://www.me.berkeley.edu/people/faculty/tarek-i-zohdi \nModeling and Simulation of Multistage Multiphysical Processes in Next-Generation Advanced Manufacturing and 3D Printing with New Multifunctional Materials\nWithin the last decade\, several industrialized countries have stressed the importance of advanced manufacturing to their economies. Many of these plans have highlighted the development of additive manufacturing techniques\, such as 3D printing\, which are still in their infancy. The objective is to develop superior products\, produced at lower overall operational costs. For these   goals to be realized\, a deep understanding of the essential ingredients comprising the materials involved in additive manufacturing is needed. The combination of rigorous material modeling theories\, coupled with the dramatic increase of computational power can potentially play a significant role in the analysis\, control\, and design of many emerging additive manufacturing processes. Specialized materials and the precise   design of their properties are key factors in the processes. Specifically\, particle-functionalized materials play a central role in this field\, in three main ways:   (1) to endow filament-based materials by adding particles to a heated binder   (2) to “functionalize” inks by adding particles to freely flowing solvents and (3) to directly deposit particles\, as dry powders\, onto surfaces and then to heat them with a laser\, e-beam or other external source\, in order to fuse them into place. The goal of these processes is primarily to build surface structures\, coatings\, etc.\, which are extremely difficult to construct using classical manufacturing methods. The objective of this presentation is to introduce the audience to basic techniques which can allow them to rapidly develop and analyze particulate-based materials needed in new additive manufacturing processes. This presentation is broken into two main parts: continuum and discrete element approaches. The materials associated with methods (1) and (2) are closely related types of continua (particles embedded in a continuous binder) and are treated using continuum approaches. The materials in method (3)\, which are of a discrete particulate character\, are analyzed using discrete element methods. \nProf. Zohdi is being hosted by Prof. Garikipati (Mechanical Engineering). If you would like to meet with him please email mcteja@umich.edu
URL:https://micde.umich.edu/event/micde-seminar-tarek-zohdi-department-of-mechanical-engineering-university-of-california-berkeley/
LOCATION:1109 FXB\, 1320 Beal Ave.\, Ann Arbor\, MI\, United States
CATEGORIES:Featured Events,MICDE Seminar Series
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GEO:42.290906;-83.713503
X-APPLE-STRUCTURED-LOCATION;VALUE=URI;X-ADDRESS=1109 FXB 1320 Beal Ave. Ann Arbor MI United States;X-APPLE-RADIUS=500;X-TITLE=1320 Beal Ave.:geo:-83.713503,42.290906
END:VEVENT
BEGIN:VEVENT
DTSTART;TZID=America/Detroit:20171121T133000
DTEND;TZID=America/Detroit:20171121T143000
DTSTAMP:20260604T032813
CREATED:20230905T171414Z
LAST-MODIFIED:20230905T171414Z
UID:10000102-1511271000-1511274600@micde.umich.edu
SUMMARY:MICDE Seminar: Edward Maginn\, Department of Chemical and Biomolecular Engineering\, University of Notre Dame
DESCRIPTION:Bio: Edward Maginn received his BS in chemical engineering from Iowa State University and his PhD in chemical engineering from the University of California\, Berkeley. Prior to attending graduate school\, he worked as a process engineer for Procter and Gamble. He has been on the Notre Dame faculty since 1995 and currently holds the Dorini Family Chair of Energy Studies in the Department of Chemical and Biomolecular Engineering. He is also the chair of the department\, and was formerly the Associate Dean for Academic Programs in the Graduate School. He has won a number of awards\, including the Early Career Award from the Computational Molecular Science and Engineering Forum of the American Institute of Chemical Engineers\, the ASEE Dow Outstanding New Faculty Award\, the BP College of Engineering Outstanding Teacher Award and the NSF Career award. He is a Fellow of the American Association for the Advancement of Science and is a trustee of the CACHE Corporation. His research focuses on the development and use of atomistic molecular dynamics and Monte Carlo simulation methods to study the thermodynamic and transport properties of materials\, with special emphasis on ionic systems important in energy storage and use. \nUsing Molecular Modeling to Design New Fluids for Energy Storage and Carbon Capture\nLiquids that contain charged species\, such as electrolytes and ionic liquids\, have many important technological applications in fields such as energy storage\, separations\, and catalysis. By changing the structure of the molecules or employing mixtures\, the properties of these fluids can be altered significantly. The key questions are: How should I change the structure of the molecule or ion to get the properties I want? What type of additives should I use to improve performance? To answer these and related questions\, we use atomistic-level simulations to compute structural\, thermodynamic and transport properties of these systems. We are able to provide molecular-level explanations for experimental observations\, and we can predict properties of systems that may not yet have even been made in the laboratory. \nIn the first part of this talk\, I will describe molecular modeling research directed at improving the performance of electrolytes used in next generation “beyond lithium” batteries. Electrolytes are a critical component of batteries\, since they transport ions from the cathode to the anode during charging\, then in the reverse direction in releasing energy on discharge. Electrolytes play a leading role in a battery’s capacity for energy storage\, its lifetime and the safety of the battery. The electrolyte in a conventional lithium-ion battery consists of a lithium salt dissolved in an organic solvent. The electrolytes for next generation “beyond lithium” batteries will require new salt-solvent combinations.  Our simulations probe the way in which different electrolyte formulations\, charge carriers and additives impact the structure and dynamics of these liquids. \nIn the second half of the talk\, I will show how these same kinds of simulations can be used to develop new ionic liquids that can be used for CO2 separations / capture. Ionic liquids are pure salts that are liquid at ambient temperatures. Because they have essentially no vapor pressure and readily dissolve CO2\, people have been interested in using them for carbon capture. I will describe how our simulations have been successful in identifying new ionic liquids with properties tuned for use as conventional liquid absorbents or as supported ionic liquid membranes. \nThis is a joint seminar with the department of Chemical Engineering. Prof. Maginn is being hosted by Prof. Mayes (Chemical Engineering). If you are interested in meeting him during his visit please send an email to mcteja@umich.edu
URL:https://micde.umich.edu/event/micde-seminar-edward-maginn-department-of-chemical-and-biomolecular-engineering-university-of-notre-dame/
CATEGORIES:Featured Events,MICDE Seminar Series
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2017/09/Edward-Maginn.png
END:VEVENT
BEGIN:VEVENT
DTSTART;TZID=America/Detroit:20171110T150000
DTEND;TZID=America/Detroit:20171110T160000
DTSTAMP:20260604T032813
CREATED:20230905T171415Z
LAST-MODIFIED:20230905T171415Z
UID:10000092-1510326000-1510329600@micde.umich.edu
SUMMARY:MICDE Seminar: Chris Rycroft\, Department of Applied Mathematics\, Harvard University
DESCRIPTION:Bio: Chris Rycroft is an Assistant Professor of Applied Mathematics in the School of Engineering and Applied Sciences at Harvard University. From 2010–2013\, he was a Morrey Assistant Professor in the UC Berkeley Mathematics Department\, and he was involved in the Bay Area Physical Sciences-Oncology where he collaborated with several experimental groups at Berkeley and UC San Francisco\, on using computational modeling to understand the role of mechanical forces between cells and their environment. Prof. Rycroft’s research focuses on mathematical modeling and scientific computation\, particularly for interdisciplinary applications in science and engineering. He works on a variety of problems\, and has collaborated in a number of fields including physics\, biology\, materials science\, and mechanical engineering. His current interests include questions that relate to the mechanics of materials\, numerical algorithms\, and geometry. Several of his recent projects relate to energy production and efficiency\, such as modeling bulk metallic glasses\, and developing high-throughput screening techniques to find advanced materials for carbon capture applications. He has also released several software libraries\, including Voro++ for three-dimensional computations of the Voronoi tessellation. \nThe reference map technique for simulating complex materials and multi-body interactions\nConventional computational methods often create a dilemma for fluid-structure interaction problems. Typically\, solids are simulated using a Lagrangian approach with grid that moves with the material\, whereas fluids are simulated using an Eulerian approach with a fixed spatial grid\, requiring some type of interfacial coupling between the two different perspectives. Here\, a fully Eulerian method for simulating structures immersed in a fluid will be presented. By introducing a reference map variable to model finite-deformation constitutive relations in the structures on the same grid as the fluid\, the interfacial coupling problem is highly simplified. The method is particularly well suited for simulating soft\, highly-deformable materials and many-body contact problems\, and several examples from engineering and biology will be presented. This is joint work with Ken Kamrin (MIT). \nThis is a joint seminar with the Interdisciplinary Applied Mathematics seminar series. \nProf. Rycroft is being hosted by Prof. Alben (Mathematics). If you would like to meet him please email Prof. Alben at alben@umich.edu or Dr. Mariana Carrasco-Teja at mcteja@umich.edu
URL:https://micde.umich.edu/event/micde-seminar-chris-rycroft-department-of-applied-mathematics-harvard-university/
LOCATION:1084 East Hall\, 530 Church St.\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:Featured Events,MICDE Seminar Series
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2017/08/Chris-Rycroft.png
GEO:42.2757302;-83.7351764
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END:VEVENT
BEGIN:VEVENT
DTSTART;TZID=America/Detroit:20171108T140000
DTEND;TZID=America/Detroit:20171108T150000
DTSTAMP:20260604T032813
CREATED:20230905T171415Z
LAST-MODIFIED:20230905T171415Z
UID:10000095-1510149600-1510153200@micde.umich.edu
SUMMARY:MICDE Seminar: Giulia Galli\, Department of Molecular Engineering\, University of Chicago
DESCRIPTION:Bio: Giulia Galli is the Liew Family Professor of Electronic Structure and Simulations in the Institute for Molecular Engineering at the University of Chicago. She also holds a Senior Scientist position at Argonne National Laboratory (ANL) and she is a Senior Fellow of the UChicago/ANL Computational Institute. Prior to joining U Chicago and ANL\, she was Professor of Chemistry and Physics at UC Davis (2005-2013) and the head of the Quantum Simulations group at the Lawrence Livermore National Laboratory (1998-2005).\nShe holds a Ph.D. in Physics from the International School of Advanced Studies (SISSA) in Trieste\, Italy. She is a Fellow of the American Physical Society (APS) and of the AAAS. She is the recipient of an award of excellence from the Department of Energy (2000) and of the Science and Technology Award from the Lawrence Livermore National Laboratory (2004). She is currently the director of MICCoM (Midwest Integrated Center for Computational Materials)\, established by DOE in 2015. Her research activity is focused on the development and use of theoretical and computational tools to understand and predict the properties and behavior of materials (solids\, liquids and nanostructures) from first principles. \nMaterials discovery and scientific design by computation: what does it take?\nSubstantial progress has been made in the last three decades in understanding and predicting the fundamental properties of materials and molecular systems from first principles\, employing electronic structure methods and atomistic simulations. Using specific examples\, I will discuss some predictions obtained for materials for energy conversion processes (photo-catalysis of water and solar cells) as well as some of the major challenges involved in enabling scientific discoveries by computation; in particular I will touch upon theoretical validation; and collection and verification of data generated by simulations. I will also discuss some of the theoretical and algorithmic advances required to broaden the scope of properties accessible by current ab initio simulations. \nProfessor Galli is being hosted by Prof. Siegel (Mechanical Engineering). If you would like to meet her during her visit please email mcteja@umich.edu
URL:https://micde.umich.edu/event/micde-seminar-giulia-galli-department-of-molecular-engineering-university-of-chicago/
CATEGORIES:Featured Events,MICDE Seminar Series
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2017/09/Giulia-Galli.png
END:VEVENT
BEGIN:VEVENT
DTSTART;TZID=America/Detroit:20171102T140000
DTEND;TZID=America/Detroit:20171102T150000
DTSTAMP:20260604T032813
CREATED:20230905T171415Z
LAST-MODIFIED:20260522T153005Z
UID:10000096-1509631200-1509634800@micde.umich.edu
SUMMARY:MICDE Seminar: Thomas Devereaux\, Photon Science\, Stanford University
DESCRIPTION:Bio: Professor Devereaux received his Ph.D. in Physics from the University of Oregon in 1991\, M.S. from University of Oregon in 1988\, and B.S from New York University in 1986. Professor Devereaux is currently the Director of the Stanford Institute for Materials and Energy Sciences (SIMES)\, the Associate Lab Director (ALD) for Photon Science\, a professor in the Photon Science Faculty at SLAC National Accelerator Laboratory and Stanford University and a Senior Fellow of the Precourt Institute for Energy. SIMES is a joint institute between Stanford main campus and SLAC\, a national laboratory\, focusing on scientific foundations related to the energy challenge facing our society. Professor Devereaux was a Post-doctoral Fellow at the Max Planck Institut\, Stuttgart\, (1991-1993)\, a Post-doctoral Fellow at the University of California\, Davis\, CA\, (1993-1996)\, an Assistant Professor at The George Washington University\, Washington\, DC\, (1996-1999)\, and an Associate Professor (1999-2006) and Professor (2006-2007) at the University of Waterloo\, Waterloo\, ON\, Canada.\nHis main research interests lie in the areas of theoretical condensed matter physics and computational physics. His research effort focuses on using the tools of computational physics to understand quantum materials. Fortunately\, we are poised in an excellent position as the speed and cost of computers have allowed us to tackle heretofore unaddressed problems involving interacting systems. The goal of his research is to understand electron dynamics via a combination of analytical theory and numerical simulations to provide insight into materials of relevance to energy science. His group carries out numerical simulations on SIMES’ high-performance supercomputer\, the National Energy Research Scientific Computing Center (NERSC)\, and other US and Canadian computational facilities. The specific focus of the group is the development of numerical methods and theories of photon-based spectroscopies of strongly correlated materials.\nProfessor Devereaux’s awards include: U. S. Department of Education Fellowship (1989-1991); Junior Scholar Incentive Award\, George Washington University (1998); Research Fellowship of the Alexander von Humboldt Foundation (2002-2006); Premier’s Research Excellence Award\, Province of Ontario (2003); Scientist Research Fellowship\, Embassy of France (2005); and Fellow of the American Physics Society (2008). \nLight controlled topological phase transitions in multi-orbital and frustrated magnetic systems\nSpurred by recent progress in melting\, enhancement and induction of electronic order out of equilibrium\, a tantalizing prospect concerns instead accessing transient Floquet steady states via broad pump pulses\, to affect electronic properties. Here\, we consider a two-pronged approach to manipulate the topology of a band insulator\, as well as topological order in a Mott insulator. We first consider monolayer transition-metal dichalcogenides (TMDCs) [1]\, and show that their low-energy description as massive 2D relativistic fermions fails to hold for optical pumping. Instead\, the added complexity of a realistic materials description leads to a novel mechanism to optically induce topologically-protected chiral edge modes\, facilitating optically-switchable conduction channels that are insensitive to disorder. We develop a strategy to understand non-equilibrium Floquet-Bloch bands and topological transitions directly from ab initio calculations\, and illustrate for the example of WS2 that control of chiral edge modes can be dictated solely from symmetry principles and is not qualitatively sensitive to microscopic materials details. Second\, we extend these ideas to strongly correlated systems and show that pumping frustrated Mott insulators with circularly-polarized light can drive the effective spin system across a phase transition to a chiral spin liquid (CSL) [2]. We show that the transient time evolution of a Kagome lattice Hubbard model is well captured by an effective spin description\, where circular polarization promotes a staggered scalar spin chirality Si . (Sj x Sk) directly to the Hamiltonian level. We fingerprint the ensuing phase diagram and find a stable photo-induced CSL in proximity to the equilibrium ground state. The results presented suggest new avenues to marry dynamical symmetry breaking\, strong interactions\, and ab initio materials modelling\, to access elusive phase transitions that are not readily accessible in equilibrium. \nReferences:\n[1] M. Claassen et al\, Nature Comm. 7\, 13074 (2016).\n[2] M. Claassen et al\, arXiv:1611.07964\, to appear in Nature Communications. \nThis is a joint CM Theory seminar. Prof. Devereaux is being hosted by Prof. Gull (Physics). If you are interested in meeting with him during his visit please send an email to mcteja@umich.edu
URL:https://micde.umich.edu/event/micde-seminar-thomas-devereaux-photon-science-stanford-university/
LOCATION:4448 East Hall\, 530 Church St\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:Featured Events,MICDE Seminar Series
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2017/09/Thomas-Devereaux.png
GEO:42.2757212;-83.7351922
X-APPLE-STRUCTURED-LOCATION;VALUE=URI;X-ADDRESS=4448 East Hall 530 Church St Ann Arbor MI 48109 United States;X-APPLE-RADIUS=500;X-TITLE=530 Church St:geo:-83.7351922,42.2757212
END:VEVENT
BEGIN:VEVENT
DTSTART;TZID=America/Detroit:20171025T150000
DTEND;TZID=America/Detroit:20171025T160000
DTSTAMP:20260604T032813
CREATED:20230905T171415Z
LAST-MODIFIED:20230905T171415Z
UID:10000091-1508943600-1508947200@micde.umich.edu
SUMMARY:MICDE Seminar: Irina Tezaur\, Extreme Scales Data Science and Analytics Department\, Sandia National Laboratories
DESCRIPTION:Bio: Dr. Irina Tezaur (f.k.a. Dr. Irina Kalashnikova) is a Principal Member of Technical Staff (PMTS) in the Extreme Scales Data Science & Analytics Department (Org. 8759) at Sandia National Laboratories in Livermore\, CA. Prior to joining this group\, from October 2011 to September 2014\, she was SMTS in the Computational Mathematics Department (Org. 1442) at Sandia in Albuquerque\, NM. She received her Ph.D. in Computational and Mathematical Engineering (CME) from Stanford University in 2011. Her advisor at Stanford was Professor Charbel Farhat and I was a member of the Farhat Research Group (FRG). Her Bachelors and Masters degrees are in pure mathematics\, awarded by the University of Pennsylvania in 2006. Dr. Tezaur’s research interests are numerical solution to PDEs\, mixed/hybrid finite element methods\, stability and convergence properties of numerical methods\, Reduced Order Modeling (ROM) and simulation-based analysis of fluid-structure interaction that she currently applies to climate modeling. \nNext-generation modeling & simulation of large-scale ice sheets towards probabilistic sea-level change projections\nRecent observations show that both the Greenland and Antarctic ice sheets are losing mass at increasingly rapid rates [1]. In its fourth assessment report (AR4)\, the Intergovernmental Panel on Climate Change (IPCC) declined to include estimates of future sea-level change from dynamics of the polar ice sheets due to the inability of ice sheet models to mimic or explain observed dynamic behaviors\, such as the acceleration and thinning then occurring on several of Greenland’s large outlet glaciers [2]. In recent years\, there has been a push to develop “next generation” land-ice models and codes for integration into global Earth System Models (ESMs). Unlike their predecessors\, these codes: (1) are able to perform realistic\, high-resolution\, continental scale simulations\, (2) are robust\, efficient and scalable on next-generation hybrid systems (multi-core\, many-core\, GPU\, Intel Xeon Phi)\, and (3) possess built-in advanced analysis capabilities (e.g.\, sensitivity analysis\, optimization\, uncertainty quantification). This talk will give an overview of the Albany/FELIX (Finite Elements for Land Ice eXperiments) [3] next-generation land-ice dynamical core (dycore) that is under development at Sandia National Laboratories as a part of a Department of Energy (DOE) SciDAC-funded project aimed at providing probabilistic sea-level projections from extreme-scale ice sheet and earth system models. This dycore is currently being integrated in to the DOE’s Acelerated Climate Model for Energy (ACME)\, which will be used to calculate anticipated 21st sea-level change projections\, including uncertainty bounds. It is widely accepted that land-ice behaves like a very viscous\, shear-thinning\, non-Newtonian fluid\, similar to lava flow. Typically\, ice sheets are modeled using a quasi-static model in which a steady momentum-balance system for the ice velocities is coupled to dynamic equations for the ice thickness and temperature. The Albany/FELIX dycore is based on the so-called “First-Order Stokes” equations for the ice momentum balance [4]\, an attractive alternative to the more expensive “Full Stokes” model because of its reduced computational cost. Following an overview of our land-ice model and project\, I will describe some of the algorithms and software we have developed as a part of this project that have contributed to our dycore’s robustness and scalability. These include: robust automatic-differentiation-based nonlinear solvers\, scalable algebraic-multigrid-based iterative linear solvers [5]\, adaptive mesh refinement capabilities\, and stable semi-implicit First-Order Stokes-thickness coupling methods. I will also discuss some of the advanced analysis capabilities in Albany/FELIX\, namely a large-scale inversion approach we have developed for obtaining optimal ice initial conditions [6]\, our workflow towards quantifying uncertainties in land-ice models\, and performance-portability of the Albany/FELIX code to new and emerging architectures using the Kokkos library [7]. I will show results which demonstrate that the Albany/FELIX dycore is scalable\, fast and robust for production-scale land-ice problems on state-of-the-art HPC machines. I will also discuss results from a recent validation study in which Albany/FELIX was used to simulate the Greenland ice sheet during the period 1991-2013 with realistic climate forcing\, and the simulation data were compared with observational data collected by NASA satellites [8]. \nThis work was done in collaboration with Irina Demeshko\, Mike Eldred\, Matt Hoffman\, John Jakeman\, Mauro Perego\, Steve Price\, Andy Salinger\, Ray Tuminaro and Jerry Watkins. \nDr. Tezaur is being hosted by Prof. Garikipati (Mechanical Engineering). If you would like to meet her please email mcteja@umich.edu \n[1] I. Velicogna. Increasing rates of ice mass loss from the Greenland and Antarctic ice sheets revealed by GRACE. Geophysical Research Letters\, 36 (19) L19503\, 2009.\n[2] S. Solomon\, D. Qin\, M. Manning\, Z. Chen\, M. Marquis\, K. Averyt\, M. Tignor\, H. Miller. Climate change 2007: The physical science basis\, Contribution of Working Group I to the Fourth Assessment Report of the Intergovernmental Panel on Climate Change\, Cambridge Univ. Press\, Cambridge\, UK\, 2007.\n[3] I. Tezaur\, M. Perego\, A. Salinger\, R. Tuminaro\, S. Price. Albany/FELIX: A Parallel\, Scalable and Robust Finite Element Higher-Order Stokes Ice Sheet Solver Built for Advanced Analysis\, Geosci. Model Develop. 8 (2015) 1-24.\n[4] J.K. Dukowicz\, S.F. Price\, W. Lipscomb. Consistent approximations and boundary conditions for ice-sheet dynamics from a principle of least action. J. Glaciol.\, 56 (197) (2010) 480-496.\n[5] R. Tuminaro\, M. Perego\, I. Tezaur\, A. Salinger\, S. Price. A matrix dependent/algebraic multigrid approach for extruded meshes with applications to ice sheet modeling\, SIAM J. Sci. Comput. 38 (5) (2016) C504-C532.\n[6] M. Perego\, S. Price\, G. Stadler. Optimal initial conditions for coupling ice sheet models to earth system models\, J. Geophys. Res.\, 119 (2014) 1894-1917.\n[7] H.C. Edwards\, C.R. Trott\, D. Sunderland. Kokkos: Enabling manycore performance portability through polymorphic memory access patterns. J. Par. and Distr. Comput.\, 74 (12) 3202–3216\, 2014.\n[8] S. Price\, M. Hoffman\, J. Bonin\, T. Neumann\, I. Howat\, J. Guerber\, I. Tezaur\, J. Saba\, J. Lanaerts\, D. Chambers\, W. Lipscomb\, M. Perego\, A. Salinger\, R. Tuminaro. An ice sheet model validation framework for the Greenland ice sheet\, Geosci. Model Dev. 10 (2017) 255-270
URL:https://micde.umich.edu/event/micde-seminar-irina-tezaur-extreme-scales-data-science-analytics-department-sandia-national-laboratories/
LOCATION:1006 H.H. Dow\, 2300 Hayward St\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:Featured Events,MICDE Seminar Series
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2017/08/Irina-Tezaur.png
GEO:42.2929214;-83.7154247
X-APPLE-STRUCTURED-LOCATION;VALUE=URI;X-ADDRESS=1006 H.H. Dow 2300 Hayward St Ann Arbor MI 48109 United States;X-APPLE-RADIUS=500;X-TITLE=2300 Hayward St:geo:-83.7154247,42.2929214
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DTSTART;TZID=America/Detroit:20171019T153000
DTEND;TZID=America/Detroit:20171019T163000
DTSTAMP:20260604T032813
CREATED:20230905T171415Z
LAST-MODIFIED:20230905T171415Z
UID:10000090-1508427000-1508430600@micde.umich.edu
SUMMARY:MICDE Seminar: Panos Papadopoulos\, Department of Mechanical Engineering\, University of California\, Berkeley
DESCRIPTION:Bio: Panos Papadopoulos is a Professor of Mechanical Engineering at the University of California\, Berkeley\, and director of the Computational Solid Mechanics Laboratory. After obtaining his Diploma in Civil Engineering from the Aristotle University\, Greece\, he moved to California to pursue his graduate studies. He obtained his M. Sc. and Ph.D. in Civil Engineering from UC Berkeley. His research involves experimental\, analytical and computational studies of several mechanics systems. Prof. Papadopoulus develops and applied the finite element method to problems in biomechanics\, dynamics of pseudo-rigid bodies\, mechanics of continues media\, plasticity\, materials science and contact mechanics. \nMultiscale Modeling in Continuum Mechanics: A connection to the Irving-Kirkwood procedure\nThis talk describes a method for extending the classical Irving-Kirkwood procedure used in statistical mechanics for extracting local fluxes to the problem of continuum-on-continuum multiscale modeling. Expressions for stress and heat flux derived here are contrasted to those obtained using the standard Hill-Mandel approach. The polar nature of the macroscopic solid and the role of multiscale invariance are also addressed in the context of this method. Applications are explored within the finite element-based homogenization of solids. \nProf. Papadopoulos is being hosted by Prof. Garikipati (Mechanical Engineering). If you would like to meet with him please send an email to mcteja@umich.edu
URL:https://micde.umich.edu/event/micde-seminar-panos-papadopoulos-department-of-mechanical-engineering-university-of-california-berkeley/
LOCATION:Johnson Rooms\, Lurie Engineering Center\, 3rd Floor LEC 3213ABC\, 1221 Beal Ave.\, Ann Arbor\, MI\, United States
CATEGORIES:Featured Events,MICDE Seminar Series,Seminar
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2017/08/Panos-Papadopoulos.png
GEO:42.2914823;-83.7138452
X-APPLE-STRUCTURED-LOCATION;VALUE=URI;X-ADDRESS=Johnson Rooms Lurie Engineering Center 3rd Floor LEC 3213ABC 1221 Beal Ave. Ann Arbor MI United States;X-APPLE-RADIUS=500;X-TITLE=1221 Beal Ave.:geo:-83.7138452,42.2914823
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DTSTART;TZID=America/Detroit:20171003T160000
DTEND;TZID=America/Detroit:20171003T170000
DTSTAMP:20260604T032813
CREATED:20230905T171439Z
LAST-MODIFIED:20230905T171439Z
UID:10000089-1507046400-1507050000@micde.umich.edu
SUMMARY:MICDE Seminar: Margaret Cheung\, Department of Physics\, University of Houston
DESCRIPTION:Bio: Margaret Cheung is an Associate Professor of Physics at the University of Houston. She graduated from the National Taiwan University with a bachelor’s degree in chemistry and received her Ph.D. in physics from the University of California\, San Diego. She carried out theoretical biological physics and bioinformatics research as a Sloan Postdoctoral Fellow at the University of Maryland and started her lab at the University of Houston in 2006. Professor Cheung’s research is in the field of protein folding inside a cell\, calmodulin dependent calcium signaling\, and quantum efficiency in artificial photosynthetic materials. She is particularly interested in developing coarse-grained models for protein dynamics in crowded systems\, creating multi-physics models that bridge dynamics across wide temporal and spatial scales\, and designing computational algorithms that effectively integrate novel high-performance resources. These systems can then be applied for understanding of biological function and for developing therapeutic strategies. She is a fellow of the American Physical Society and a Senior Scientist at the Center for Theoretical Biological Physics at Rice University. \nMolecular Underpinning of Postsynaptic Calmodulin-dependent Calcium Signaling\nCalcium (Ca2+) is exquisitely utilized by a cell for transducing external stimuli through its gradient of extracellular (~1000 μM) and intracellular (~0.1 μM) concentration. A broad spectrum of Ca2+ signals are encoded by protein calmodulin (CaM) through specific binding with various targets regulating CaM-dependent Ca2+ signaling pathways in neurons. I will focus on binding between CaM and two specific targets\, Ca2+/CaM-dependent protein kinase II (CaMKII) and neurogranin (Ng)\, as they antagonistically regulate CaM-dependent Ca2+ signaling pathways in neurons. I will show the impact of bound calmodulin (CaM)-target compound structure on the affinity of calcium (Ca2+) by integrating coarse-grained models and all-atomistic simulations with non-equilibrium physics. We discovered the molecular underpinnings of lowered affinity of Ca2+ for CaM in the presence of Ng by showing that the N-terminal acidic region of Ng peptide pries open the β-sheet structure between the Ca2+ binding loops particularly at C-domain of CaM\, enabling Ca2+ release. In contrast\, CaMKII peptide increases Ca2+ affinity for the C-domain of CaM by stabilizing the two Ca2+ binding loops. Through distinctive structural differences in the bound complexes of apoCaM-Ng13-49 and holoCaM-CaMKII\, CaM’s affinity for Ca2+ is delineated by its progressive mechanism of target binding. I will discuss them in the context of evolution and in the crowded environment. \nProf. Cheung is being hosted by Prof. Geva (Chemistry)
URL:https://micde.umich.edu/event/micde-seminar-margaret-cheung-department-of-physics-university-of-houston/
LOCATION:CHEM 1640\, 930 N University\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:Featured Events,MICDE Seminar Series,Seminar
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2017/08/Margaret-Cheung.png
GEO:42.2780183;-83.7370191
X-APPLE-STRUCTURED-LOCATION;VALUE=URI;X-ADDRESS=CHEM 1640 930 N University Ann Arbor MI 48109 United States;X-APPLE-RADIUS=500;X-TITLE=930 N University:geo:-83.7370191,42.2780183
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DTSTART;TZID=America/Detroit:20170418T083000
DTEND;TZID=America/Detroit:20170418T170000
DTSTAMP:20260604T032813
CREATED:20230905T171438Z
LAST-MODIFIED:20230905T171438Z
UID:10000047-1492504200-1492534800@micde.umich.edu
SUMMARY:2017 MICDE Annual Symposium
DESCRIPTION:Please join us for the Michigan Institute for Computational Discovery and Engineering 2017 Symposium. The event features eminent scientists from around the world and the U-M campus. The symposium this year focuses on the “New Era of Data-Enabled Computational Science.” \nSpeakers: \n\nFrederica Darema — Director\, Air Force Office of Scientific Research\nGeorge Karniadakis —  Professor of Applied Mathematics\, Brown University\nTinsley Oden — Director of the Institute for Computational Engineering and Sciences\, V.P. for Research\, University of Texas at Austin\nKaren Willcox — Professor of Aerospace and Aeronautics\, Massachusetts Institute of Technology\, co-Director of MIT Center for Computational Engineering\nJacqueline H. Chen — Distinguished Member of Technical Staff at the Combustion Research Facility\, Sandia National Laboratories\nLaura Balzano — Assistant Professor\, Electrical Engineering and Computer Science\, U-M\nEmanuel Gull — Assistant Professor\, Physics\n\nThe symposium features a poster competition and more. For more information and to register go to https://live-umor-micde.pantheonsite.io/symposium17/ \nPast Symposia\n2016 MICDE Annual Symposium \nResearch Computing Symposium Fall 2014  \n 
URL:https://micde.umich.edu/event/2017-micde-annual-symposium/
LOCATION:Rackham Building\, 4th Floor\, 915 E. Washington\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:MICDE Seminar Series
ATTACH;FMTTYPE=image/jpeg:https://micde.umich.edu/wp-content/uploads/2022/04/MICDE2016SymposiumFrontPage.jpg
GEO:42.2807892;-83.7381556
X-APPLE-STRUCTURED-LOCATION;VALUE=URI;X-ADDRESS=Rackham Building 4th Floor 915 E. Washington Ann Arbor MI 48109 United States;X-APPLE-RADIUS=500;X-TITLE=915 E. Washington:geo:-83.7381556,42.2807892
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DTSTART;TZID=America/Detroit:20170317T110000
DTEND;TZID=America/Detroit:20170317T120000
DTSTAMP:20260604T032813
CREATED:20230905T171438Z
LAST-MODIFIED:20230905T171438Z
UID:10000072-1489748400-1489752000@micde.umich.edu
SUMMARY:MICDE Seminar: Yongjie Jessica Zhang\, Mechanical Engineering and Biomedical Engineering\, Carnegie Mellon University
DESCRIPTION:Bio: Yongjie Jessica Zhang is a Professor in Mechanical Engineering at Carnegie Mellon University with a courtesy appointment in Biomedical Engineering. She received her B.Eng. in Automotive Engineering\, and M.Eng. in Engineering Mechanics from Tsinghua University\, China; and M.Eng. in Aerospace Engineering and Engineering Mechanics and Ph.D. in Computational Engineering and Sciences from Institute for Computational Engineering and Sciences (ICES)\, The University of Texas at Austin. After staying two years at ICES as a postdoctoral fellow\, she joined CMU in 2007 as an assistant professor\, and then was promoted to an associate professor in 2012 and a full professor in 2016. Her research interests include computational geometry\, mesh generation\, computer graphics\, visualization\, finite element method\, isogeometric analysis and their application in computational biomedicine\, material sciences and engineering. She has co-authored over 140 publications in peer-reviewed journals and conference proceedings\, and received the Autodesk Best Paper Award 1st Place in SIAM Conference on Solid and Physical Modeling 2015\, the Best Paper Award in CompIMAGE’16 conference and one of the 5 Most Highly Cited Papers Published in Computer-Aided Design during 2014-2016. She recently published a book entitled “Geometric Modeling and Mesh Generation from Scanned Images” with CRC Press\, Taylor & Francis Group. She is the recipient of Presidential Early Career Award for Scientists and Engineers\, NSF CAREER Award\, Office of Naval Research Young Investigator Award\, USACM Gallagher Young Investigator Award\, Clarence H. Adamson Career Faculty Fellow in Mechanical Engineering\, George Tallman Ladd Research Award\, and Donald L. & Rhonda Struminger Faculty Fellow. \nImage-Based Mesh Generation and Volumetric T-Spline Modeling for Isogeometric Analysis with Engineering Applications\nWith finite element method and scanning technology seeing increased use in many research areas\, there is an emerging need for high-fidelity geometric modeling and mesh generation of spatially realistic domains. This talk will highlight research in three areas: image-based mesh generation for complicated domains\, trivariate spline modeling for isogeometric analysis\, as well as biomedical\, material sciences and engineering applications. First Prof. Zhang will present advances and challenges in image-based geometric modeling and meshing along with a comprehensive computational framework\, which integrates image processing\, geometric modeling\, mesh generation and quality improvement with multi-scale analysis at molecular\, cellular\, tissue and organ scales. Different from other existing methods\, the presented framework supports five unique features: high-fidelity meshing for heterogeneous domains with topology ambiguity resolved; multiscale geometric modeling for biomolecular complexes; automatic all-hexahedral mesh generation with sharp feature preservation; robust quality improvement for non-manifold meshes; and guaranteed-quality meshing. These unique capabilities enable accurate\, stable\, and efficient mechanics calculation for many biomedicine\, materials science and engineering applications. As a new advancement of traditional finite element method\, isogeometric analysis (IGA) was proposed to integrate design and analysis. In the second part of this talk\, she will present her latest research on volumetric T-spline parameterization for IGA applications. For arbitrary-topology objects\, we first build a polycube whose topology is equivalent to the input geometry and it serves as the parametric domain for the following trivariate T-spline construction. Boolean operations\, geometry skeleton and centroidal Voronoi tessellation based surface segmentation are used to preserve surface features. A parametric mapping is then used to build a one-to-one correspondence between the input geometry and the polycube boundary. After that\, we choose the deformed octree subdivision of the polycube as the initial T-mesh\, and make it valid through pillowing\, quality improvement\, and applying templates or truncated subdivision schemes to handle extraordinary nodes. Weighted and truncated T-spline basis functions are derived to enable analysis-suitability\, including partition of unity and linear independence. The developed pipelines have been incorporated into commercial software such as Rhino and Abaqus. \nProf. Zhang is being hosted by Prof. Garikipati (Mechanical Engineering)
URL:https://micde.umich.edu/event/micde-seminar-yongjie-jessica-zhang-mechanical-engineering-and-biomedical-engineering-carnegie-mellon-university/
LOCATION:1200 EECS\, 1301 Beal Ave.\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:Featured Events,MICDE Seminar Series,Seminar
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2017/02/Yongjie-Jessica-Zhang.png
GEO:42.292322;-83.713272
X-APPLE-STRUCTURED-LOCATION;VALUE=URI;X-ADDRESS=1200 EECS 1301 Beal Ave. Ann Arbor MI 48109 United States;X-APPLE-RADIUS=500;X-TITLE=1301 Beal Ave.:geo:-83.713272,42.292322
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DTSTART;TZID=America/Detroit:20170308T140000
DTEND;TZID=America/Detroit:20170308T150000
DTSTAMP:20260604T032813
CREATED:20230905T171438Z
LAST-MODIFIED:20230905T171438Z
UID:10000071-1488981600-1488985200@micde.umich.edu
SUMMARY:SC2/MICDE Seminar: Eric Jankowski\, Materials Science and Engineering\, Boise State University
DESCRIPTION:Bio: Eric Jankowski is an assistant professor of Materials Science and Engineering at Boise State University. He earned his PhD in Chemical Engineering from the University of Michigan in 2012\, where he developed computational tools to study the self-assembly of nanoparticles. These tools leveraged graphics processors to accelerate computations and provided insight into systems of both theoretical and practical importance. Dr. Jankowski began focusing on renewable energy generation during his postdoctoral positions at the University of Colorado and the National Renewable Energy Laboratory. At these postdocs\, Dr. Jankowski applied techniques he developed during his thesis to understand factors that determine the ordering of molecules in organic solar cells. \nThis is a joint seminar of the Scientific Computing Student Club and MICDE\, sponsored in part by U-M Rackham Graduate School.   \n  \nCobbling together computational components to engineer inexpensive plastic solar panels\nIn order to meet projected global energy demands over the next 25 years\, the equivalent of building a 1GW power plant each day is needed. Existing clean power generation technologies can meet this demand in principle\, but their relatively large short-term costs have limited widespread adoption. In this work we explain manufacturing strategies for organic (plastic) solar panels that overcome economic barriers to adoption by optimizing the structure of the organic active layer responsible for generating electricity. We perform coarse-grained molecular dynamics simulations accelerated with graphics processing units to determine the thermodynamically stable morphologies for a variety of candidate ingredients. Using these morphologies we perform kinetic Monte Carlo charge transport simulations to determine which morphologies are better candidates for solar devices. The simulation pipeline developed here combines computational tools developed for solving unrelated problems\, and we discuss the evolving landscape of scientific computing education and how it overlaps with this work. \n 
URL:https://micde.umich.edu/event/sc2micde-seminar-eric-jankowski-material-science-and-engineering-boise-state-university/
LOCATION:2540 G.G. Brown (2350 Hayward St.)\, 2300 Hayward St\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:Featured Events,MICDE Seminar Series,Seminar
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2017/02/Eric-Jankowski.png
GEO:42.292998;-83.7152904
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DTSTART;TZID=America/Detroit:20170307T160000
DTEND;TZID=America/Detroit:20170307T170000
DTSTAMP:20260604T032813
CREATED:20230905T171438Z
LAST-MODIFIED:20230905T171438Z
UID:10000073-1488902400-1488906000@micde.umich.edu
SUMMARY:MICDE Seminar: Michael Eldred\, Computation\, Computers\, Information\, and Mathematics Center\, Sandia National Laboratories
DESCRIPTION:Bio: Michael Eldred is a Distinguished Member of the Technical Staff in the Optimization and Uncertainty Quantification Department within the Computation\, Computers\, Information\, and Mathematics Center at Sandia National Laboratories. He received his B.S. in Aerospace Engineering from Virginia Tech in 1989\, his M.S.E. and Ph.D. in Aerospace Engineering from the University of Michigan in 1990 and 1993. Mike led the DAKOTA project\, a “… toolkit that provides a flexible\, extensible interface between analysis codes and iterative systems analysis methods…”\, for 15 years (1994-2009) and now leads algorithm research and development activities related to DAKOTA. Mike’s research interests include uncertainty quantification\, design under uncertainty\, surrogate-based optimization\, and high-performance computing\, with application to stockpile stewardship and energy initiatives through the NNSA ASC\, DOE ASCR\, and DOE SciDAC programs. \nMike is an Associate Fellow of the American Institute of Aeronautics and Astronautics (AIAA) and a member of the Society for Industrial and Applied Mathematics (SIAM)\, the International Society for Structural and Multidisciplinary Optimization (ISSMO)\, and the United States Association for Computational Mechanics (USACM). He currently serves as a member of the AIAA Nondeterministic Approaches Technical Committee and on the editorial board for the International Journal for Uncertainty Quantification. A number of his publications are available on the DAKOTA web site. \nTitle: Multilevel-Multifidelity Approaches for Uncertainty Quantification and Design\nIn the simulation of complex physics\, multiple model forms of varying fidelity and resolution are commonly available. In computational fluid dynamics\, for example\, common model fidelities include potential flow\, inviscid Euler\, Reynolds-averaged Navier-Stokes\, and large eddy simulation\, which may be further augmented by subgrid-scale model selections and spatio-temporal discretization levels. In this presentation\, we focus on novel algorithms that simultaneously exploit multiple model forms and multiple resolutions\, both for uncertainty quantification (UQ) and for optimization under uncertainty (OUU). These hybrid methods exploit multifidelity methods across the model form hierarchy in combination with multilevel accelerators across an associated discretization hierarchy\, manifesting as multilevel control variate Monte Carlo and multilevel polynomial expansion methods in the UQ case and recursive trust-region and multigrid optimization in the OUU case. These techniques will be demonstrated for both model problems and engineered systems\, and will be placed within the broader context of algorithm research and development within the Dakota project at Sandia. \nDr. Eldred is being hosted by Prof. Duraisamy (Aerospace Engineering) 
URL:https://micde.umich.edu/event/micde-seminar-michael-eldredcomputation-computers-information-and-mathematics-center-sandia-national-laboratories/
LOCATION:1008 FXB\, 1320 Beal Ave\, Ann Arbor\, MI\, 48109
CATEGORIES:Featured Events,MICDE Seminar Series,Seminar
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2017/02/Michael-Eldred.png
GEO:42.2934832;-83.7119819
X-APPLE-STRUCTURED-LOCATION;VALUE=URI;X-ADDRESS=1008 FXB 1320 Beal Ave Ann Arbor MI 48109;X-APPLE-RADIUS=500;X-TITLE=1320 Beal Ave:geo:-83.7119819,42.2934832
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DTSTART;TZID=America/Detroit:20170214T150000
DTEND;TZID=America/Detroit:20170214T160000
DTSTAMP:20260604T032813
CREATED:20230905T171440Z
LAST-MODIFIED:20230905T171440Z
UID:10000066-1487084400-1487088000@micde.umich.edu
SUMMARY:MICDE Seminar: Steven White\, Physics & Astronomy\, University of California Irvine
DESCRIPTION:Bio: Steven White did his bachelor’s degree at the University of California in San Diego and received his Ph.D. from Cornell University. Early in his career he was awarded a National Science Foundation fellowship\, and an IBM postdoctoral fellowship. He’s been named an American Physical Society fellow\, and a fellow of the American Association for the Advancement of Science\, and of the American Academy of Arts and Science\, among others. Professor White is most known for inventing the Density Matrix Renormalization Group (DMRG)\, a numerical variation technique for high accuracy calculations of the low energy physics of quantum many-body systems. In 2003 he won the American Physical Society Aneesur Rahman prize\, a recognition of outstanding achievement in computational physics research “…for his development\, application\, and dissemination of the DMRG method”. He has published over one hundred and seventy papers on this and related subjects. \nTensor Network methods for Electronic Structure\nOur conventional picture of wave functions living in an exponentially large Hilbert space is both impractical for solving many particle systems and conceptually lacking: in recent years we have come to understand that physical states of matter live in an infinitesimal corner of Hilbert space\, characterized primarily by low entanglement. Tensor networks are the natural language to express low entanglement wave functions\, giving an exponentially compressed description of ground states. The density matrix renormalization group (DMRG) and other tensor network algorithms have had tremendous success in simulating quantum lattice models.The key challenge in translating these methods to electronic structure is the need to represent continuum space in an efficient way. After an introduction to tensor networks\, I’ll present a new DMRG-based approach suitable for the electronic structure of long molecules. Our sliced-basis DMRG method produces near-exact ground states within its basis\, and has a computation time which is linear in the length of the molecule. We are implementing SBDMRG for chains of hydrogen atoms\, where we have been able to simulate up to 1000 atoms in a minimal basis. \nProf. White is being hosted by Prof. Emanuel Gull (Chemistry)
URL:https://micde.umich.edu/event/micde-seminar-steven-white-physics-astronomy-university-of-california-irvine/
LOCATION:340 West Hall\, 1085 South University Ave.\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:Featured Events,MICDE Seminar Series,Seminar
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2017/01/Steven-White.png
GEO:42.2757556;-83.7362041
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END:VEVENT
BEGIN:VEVENT
DTSTART;TZID=America/Detroit:20170203T100000
DTEND;TZID=America/Detroit:20170203T110000
DTSTAMP:20260604T032813
CREATED:20230905T171440Z
LAST-MODIFIED:20230905T171440Z
UID:10000065-1486116000-1486119600@micde.umich.edu
SUMMARY:MICDE Seminar: Anna Krylov\, Chemistry\, University of Southern California
DESCRIPTION:Bio: Anna Krylov is a Gabilan Distinguished Professor in Science and Engineering\, Chemistry at the University of Southern California. She received her M.Sc. in Chemistry from Moscow State University and later her Ph.D. from The Hebrew University of Jerusalem. Upon completing her Ph.D. in 1996 (summa cum laude)\, she joined the group of Prof. Martin Head-Gordon at the University of California\, Berkeley as a postdoctoral research associate\, where she first became involved with electronic structure method development. In 1998\, she joined Department of Chemistry at USC. Currently\, Prof. Krylov leads a research group focused on theoretical modeling of open shell and electronically excited species. She is the head of the Center for Computational Studies of Electronic Structure and Spectroscopy of Open-Shell and Electronically Excited Species\, iOpenShell\, supported by the National Science Foundation (2005–2011) and the University of Southern California. She is developing robust black-box methods aiming to describe complicated multi-configurational wave functions in a single-reference formalism\, such as coupled-cluster and equation-of-motion (or linear response) approaches. She has developed the spin-flip approach\, which extends coupled-cluster and density functional methods to diradicals\, triradicals\, and bond-breaking. Using computational chemistry tools\, and in collaboration with numerous experimental groups\, Krylov is also investigating the role that radicals and electronically excited species play in such diverse areas as combustion\, gas- and condensed-phase chemistry\, solar energy applications\, bioimaging\, and ionization-induced processes in biology. She has co-authored more than 120 publications and has delivered more than 130 invited lectures. (Source https://en.wikipedia.org/wiki/Anna_Krylov) \nFission of entangled spins: Electronic structure perspective\nSinglet fission (SF)\, a process in which one singlet excited state is converted into two triplet states\, is of interest in the context of organic photovoltaic technology. Owing to its technological significance\, the mechanism of SF has been vigorously investigated. Yet\, the design principles for materials capable of efficient SF remain elusive. The main challenge faced by theory is a complex and intricate electronic structure of the process\, which involves non-adiabatic transitions between strongly correlated states. This lecture will discuss electronic structure of the relevant states\, the nature of non-adiabatic couplings\, and the connection between electronic factors and rates\, emphasizing the methodological aspects of the problem. The utility of theory will be illustrated by examples. Recent experimental and theoretical studies of SF in covalently linked tetracene dimers shed light on the effect of the linkers on the electronic factors and SF rates\, illuminating the role of through-space and through-bond interactions between the chromophores. The results highlight the importance of integrative approaches that evaluate the overall rate\, rather than focus on specific electronic factors\, such as energies or couplings.
URL:https://micde.umich.edu/event/micde-seminar-anna-krylov-chemistry-university-of-southern-california/
LOCATION:CHEM 1640\, 930 N University\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:Featured Events,MICDE Seminar Series,Seminar
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GEO:42.2780183;-83.7370191
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END:VEVENT
BEGIN:VEVENT
DTSTART;TZID=America/Detroit:20170127T120000
DTEND;TZID=America/Detroit:20170127T130000
DTSTAMP:20260604T032813
CREATED:20230905T171439Z
LAST-MODIFIED:20230905T171439Z
UID:10000064-1485518400-1485522000@micde.umich.edu
SUMMARY:MICDE Seminar: Vipin Kumar\, Computer Science and Engineering\, University of Minnesota
DESCRIPTION:Bio: Vipin Kumar is a Regents Professor and holds William Norris Chair in the department of Computer Science and Engineering  at the University of Minnesota.  His research interests include data mining\, high-performance computing\, and their applications in Climate/Ecosystems and health care. He is currently leading an NSF Expedition project on understanding climate change using data driven approaches.  He has authored over 300 research articles\, and co-edited or coauthored 10 books including the widely used text book “Introduction to Parallel Computing”\, and “Introduction to Data Mining”.  Kumar co-founded SIAM International Conference on Data Mining and served as a founding co-editor-in-chief of Journal of Statistical Analysis and Data Mining (an official journal of the American Statistical Association).  Kumar is a Fellow of the ACM\, IEEE and AAAS.  He received the Distinguished Alumnus Award from the Indian Institute of Technology (IIT) Roorkee (2013) and the Distinguished Alumnus Award from the Computer Science Department\, University of Maryland College Park (2009).  Kumar’s foundational research in data mining and high performance computing has been honored by the ACM SIGKDD 2012 Innovation Award\, which is the highest award for technical excellence in the field of Knowledge Discovery and Data Mining (KDD)\, and the 2016 IEEE Computer Society Sidney Fernbach Award\, one of IEEE Computer Society’s highest awards. \nBig Data in Climate: Opportunities and Challenges for Machine Learning and Data Mining\nThis talk will present an overview of research being done in a large interdisciplinary project on the development of novel data mining and machine learning approaches for analyzing massive amount of climate and ecosystem data now available from satellite and ground-based sensors\, and physics-based climate model simulations. These information-rich data sets offer huge potential for monitoring\, understanding\, and predicting the behavior of the Earth’s ecosystem and for advancing the science of global change. This talk will discuss challenges in analyzing such data sets and some of our research results in mapping the dynamics of surface water globally as well as detecting deforestation and fires in tropical forests using data from Earth observing satellites. \nResearch funded by the NSF Expeditions in Computing Program and  NASA \nPizza lunch will be provided
URL:https://micde.umich.edu/event/micde-seminar-vipin-kumar-computer-science-and-engineering-university-of-minnesota/
LOCATION:1008 EECS\, 1301 Beal Ave.\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:Featured Events,MICDE Seminar Series,Seminar
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2016/12/Vipin-Kumar.png
GEO:42.292322;-83.713272
X-APPLE-STRUCTURED-LOCATION;VALUE=URI;X-ADDRESS=1008 EECS 1301 Beal Ave. Ann Arbor MI 48109 United States;X-APPLE-RADIUS=500;X-TITLE=1301 Beal Ave.:geo:-83.713272,42.292322
END:VEVENT
BEGIN:VEVENT
DTSTART;TZID=UTC:20161209T110000
DTEND;TZID=UTC:20161209T120000
DTSTAMP:20260604T032813
CREATED:20230905T171440Z
LAST-MODIFIED:20230905T171440Z
UID:10000044-1481281200-1481284800@micde.umich.edu
SUMMARY:MICDE Seminar: Ann Almgren\, Lawrence Berkeley National Lab
DESCRIPTION:Bio:  Ann Almgren is a senior scientist in the Computational Research Division of Lawrence Berkeley National Laboratory and the Group Lead of the Center for Computational Sciences and Engineering. Her primary research interest is in computational algorithms for solving PDE’s for fluid dynamics in a variety of application areas. Her current projects include the development and implementation of new multiphysics algorithms in high-resolution adaptive mesh codes that are designed for the latest multicore architectures.  She is a SIAM Fellow and serves on the editorial boards of CAMCoS and SIREV. \nNext-Generation AMR\nBlock-structured adaptive mesh refinement (AMR) is a powerful tool for improving the computational efficiency and reducing the memory footprint of structured-grid numerical simulations. AMR techniques have been used for over 25 years to solve increasingly complex problems.  I will give an overview of recent and planned advances in AMR algorithms and implementations at BerkeleyLab to address the challenges of next-generation multicore architectures and the complexity of multiscale\, multiphysics problems.  This will include new ways of thinking about multilevel algorithms and new approaches to data layout and load balancing\, in situ and in transit visualization and analytics\, and run-time performance modeling and control. \n  \n  \n  \n 
URL:https://micde.umich.edu/event/micde-seminar-ann-almgren-lawrence-berkeley-national-lab/
LOCATION:1013 H. H. Dow\, 2300 Hayward St.\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:MICDE Seminar Series
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2016/08/Ann-Almgren.png
GEO:42.292998;-83.7152904
X-APPLE-STRUCTURED-LOCATION;VALUE=URI;X-ADDRESS=1013 H. H. Dow 2300 Hayward St. Ann Arbor MI 48109 United States;X-APPLE-RADIUS=500;X-TITLE=2300 Hayward St.:geo:-83.7152904,42.292998
END:VEVENT
BEGIN:VEVENT
DTSTART;TZID=America/Detroit:20161202T140000
DTEND;TZID=America/Detroit:20161202T150000
DTSTAMP:20260604T032813
CREATED:20230905T171440Z
LAST-MODIFIED:20230905T171440Z
UID:10000062-1480687200-1480690800@micde.umich.edu
SUMMARY:MICDE/RadLab/IEEE Seminar: Levent Gürel\, ABAKUS Computing Technologies
DESCRIPTION:Bio: Prof. Levent Gürel (Fellow of IEEE\, ACES\, and EMA) received the M.S. and Ph.D. degrees from the University of Illinois at Urbana-Champaign (UIUC) in 1988 and 1991\, respectively\, in electrical and computer engineering. He worked at the IBM Thomas J. Watson Research Center\, Yorktown Heights\, New York\, in 1991-94. During his 20 years with Bilkent University\, he served as the Founding Director of the Computational Electromagnetics Research Center (BiLCEM) and a professor of electrical engineering. He is also an Adjunct Professor at UIUC. Prof. Gürel is the Founder and CEO of ABAKUS Computing Technologies\, a company that is geared towards advancing the use of cutting-edge computing technologies for solving difficult scientific problems with important real-life applications and societal benefits. He is conferred the UIUC ECE Distinguished Alumni Award in 2013 and the IEEE Harrington-Mittra Award in Computational Electromagnetics in 2015. He is an IEEE Distinguished Lecturer. He was invited to address the 2011 and 2017 ACES Conferences as a Plenary Speaker and a TEDx Conference in 2014. Among other recognitions of Prof. Gürel’s accomplishments\, the two prestigious awards from the Turkish Academy of Sciences (TUBA) in 2002 and the Scientific and Technological Research Council of Turkey (TUBITAK) in 2003 are the most notable. Since 2003\, Prof. Gürel has been serving as an associate editor for Radio Science\, IEEE Transactions on Antennas and Propagation\, IEEE Antennas and Wireless Propagation Letters\, IET Microwaves\, Antennas & Propagation\, JEMWA\, PIER\, ACES Journal\, and ACES Express. \nSolution of Extremely Large Forward and Inverse Problems in Computational Electromagnetics: BIG DATA Aspects\nAs we solve some of the largest problems in the interdisciplinary domain of computational electromagnetics\, we have to deal with various aspects of big-data issues routinely. Most recently\, we have achieved the solutions of larger than 1\,500\,000\,000×1\,500\,000\,000 (1.5 billion!) dense matrix equations! This achievement is an outcome of a multidisciplinary effort involving physical understanding of electromagnetics problems\, novel parallelization strategies (computer science)\, constructing parallel clusters (computer architecture)\, advanced mathematical methods for integral equations\, fast solvers\, iterative methods\, preconditioners\, linear algebra\, and big data. Solving such large problems on a regular basis requires the generation\, representation\, storage\, processing\, analysis\, transfer and communication\, visualization and interpretation of extremely large data sets in the order of multiple terabytes. \nAccurate formulations of real-life electromagnetics problems with integral equations necessitate the solution of extremely large dense matrix equations. Solutions of such tremendously challenging problems cannot be achieved easily\, even when using the most powerful computers with state-of-the-art petascale computing capabilities. Instead\, we have been solving some of the world’s largest integral-equation problems in computational electromagnetics by employing fast algorithms implemented on parallel computers. To achieve optimal management of multiple large data sets\, we design and implement the handling of data in various levels of cache\, memory\, and disk\, leading to meticulously designed out-of-core (OoC) schemes. That way\, we enable the solution of unprecedentedly large problems with limited amounts of DRAM. In order to avoid decelerating the solution\, we optimize communications among CPU cores\, among processors\, among nodes\, from CPU to disk (and back)\, and in the case of heterogeneous architectures\, we carefully control the data traffic to/from GPUs. Furthermore\, we employ MPI and OpenMP simultaneously in a parallelization strategy designed to reduce data duplications among processes so that vast numbers of cores can be efficiently utilized without requiring extra memory. \nI will present fast and accurate solutions of large-scale electromagnetic forward and inverse problems involving three-dimensional geometries that are larger than 1000 wavelengths using the multilevel fast multipole algorithm (MLFMA) and parallel MLFMA. Solving the world’s largest computational electromagnetics problems has important implications in terms of obtaining the solutions of future grand-challenge problems in imaging\, (subsurface)\, optics\, nanotechnology\, bio-electromagnetics\, metamaterials\, remote sensing\, as well as plethora of other disciplines of science\, e.g.\, acoustics\, elastics\, quantum mechanics\, astrophysics\, molecular dynamics\, electro-statics\, fluid dynamics\, thermodynamics. For more information: http://captains.of.computing.technology/.
URL:https://micde.umich.edu/event/micderadlabieee-seminar-levent-gurel-abakus-computing-technologies/
LOCATION:3427 EECS\, 1301 Beal Ave.\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:Education,Featured Events,MICDE Seminar Series,Seminar
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2016/11/Levent-Gurel.png
GEO:42.292322;-83.713272
X-APPLE-STRUCTURED-LOCATION;VALUE=URI;X-ADDRESS=3427 EECS 1301 Beal Ave. Ann Arbor MI 48109 United States;X-APPLE-RADIUS=500;X-TITLE=1301 Beal Ave.:geo:-83.713272,42.292322
END:VEVENT
BEGIN:VEVENT
DTSTART;TZID=UTC:20161026T161000
DTEND;TZID=UTC:20161026T170000
DTSTAMP:20260604T032813
CREATED:20230905T171439Z
LAST-MODIFIED:20260522T154116Z
UID:10000043-1477498200-1477501200@micde.umich.edu
SUMMARY:MICDE Seminar: Andrea Lodi\, Polytechnique Montréal
DESCRIPTION:Bio:  Andrea Lodi received a PhD in System Engineering from the University of Bologna in 2000 and he was a Herman Goldstine Fellow at the IBM Mathematical Sciences Department\, NY from 2005–2006. He was a full professor of Operations Research at DEI\, University of Bologna between 2007 and 2015. Since 2015 he has been the Canada Excellence Research Chair in “Data Science for Real-time Decision Making” at the Polytechnique Montréal. His main research interests are in Mixed-Integer Linear and Nonlinear Programming and Data Science and his work has received recognition including the IBM and Google faculty awards. He is author of more than 80 publications in the top journals of the field of Mathematical Optimization. He serves as Associate Editor for several prestigious journals in the area. He has been the network coordinator and principal investigator of two large EU projects/networks\, and\, since 2006\, consultant of the IBM CPLEX research and development team. Finally\, Andrea Lodi is the co-principal investigator (with Yoshua Bengio) of the project “Data Serving Canadians: Deep Learning and Optimization for the Knowledge Revolution”\, recently funded by the Canadian Federal Government under the Apogée Programme. \nOn Wide Split Cuts for Mixed-Integer Programming\nCutting planes (or simply cuts) are a fundamental component of modern Mixed-Integer Linear Programming (MILP) solvers because they help in strengthening the linear programming relaxation\, a proxy to make the branchand-bound tree small. A classical way of devising cuts is to exploit disjunctions\, for example in the domain of an integer variable\, where\, of course\, no fractional value leads to any feasible solution. Cutting planes of this type\, called split cuts\, classically exploit disjunctions whose ‘width’ is always equal to one\, i.e.\, no fractional value is feasible between two consecutive integer values. We investigate cutting planes that arise when widening the associated disjunctions. This allows\, e.g.\, to model non contiguous domains of (integer) variables (or\, stated differently\, ‘holes’ in the domains). The validity of the disjunctions in a MILP can come from either primal or dual information\, and we present examples and computational results in both cases. We further explore an exact MILP approach based on these cutting planes\, that in addition tackles non-contiguity directly via branching and as a side-effect reduces the model size. (Joint work with P. Bonami\, F. Serrano\, A. Tramontani\, S. Wiese.) \nThis seminar is co-sponsored by the U-M Department of Industrial & Operations Engineering
URL:https://micde.umich.edu/event/micde-seminar-andrea-lodi-ecole-polytechnique-montreal/
LOCATION:Boeing Auditorium –  1109 Francois-Xavier Bagnoud Building\, 1320 Beal Ave.\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:MICDE Seminar Series
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2016/08/Andrea-Lodi.png
GEO:42.2934378;-83.7118764
X-APPLE-STRUCTURED-LOCATION;VALUE=URI;X-ADDRESS=Boeing Auditorium –  1109 Francois-Xavier Bagnoud Building 1320 Beal Ave. Ann Arbor MI 48109 United States;X-APPLE-RADIUS=500;X-TITLE=1320 Beal Ave.:geo:-83.7118764,42.2934378
END:VEVENT
BEGIN:VEVENT
DTSTART;TZID=UTC:20161014T151000
DTEND;TZID=UTC:20161014T160000
DTSTAMP:20260604T032813
CREATED:20230905T171443Z
LAST-MODIFIED:20230905T171443Z
UID:10000042-1476457800-1476460800@micde.umich.edu
SUMMARY:MICDE Seminar: Anthony Wachs\, University of British Columbia
DESCRIPTION:Bio: Anthony Wachs is an assistant professor with a joint appointment in the departments of Mathematics and of Chemical and Biological Engineering at the University of British Columbia\, Vancouver\, Canada. He received his B. Sc. and M. Sc. from the University Louis Pasteur of Strasbourg and his PhD from the Institut National Polytechnique of Grenoble in 2000. Right after\, he was hired in 2001 as a Fluid Mechanics research engineer at IFP Energies nouvelles (IFPEN\, at that time Institut Français du Pétrole) in Paris. \nIn 2009\, he spent a one-year sabbatical at the nuclear research center of Cadarache in the south of France\, where he worked for IRSN (the french national safety administration for nuclear energy). In 2010\, he got his HDR (French Habilitation to Supervise Research) and was later promoted Scientific Advisor at IFPEN in Multiphase Flows and Scientific Computing. He then moved to IFPEN-Lyon where he supervised a group of researchers (including PhD and post-doc students) on the numerical simulation of reactive particulate flows (www.peligriff.com). \nHis main research interests are non-Newtonian Flows\, Multiphase Flows and High Performance Computing. He collaborates extensively with academic groups in Canada\, Brazil\, France and Germany. \nMicro/meso numerical modeling of flows laden with particles of arbitrary shape\nParticulate flows are ubiquitous in environmental\, geophysical and engineering processes. The intricate dynamics of these two-phase flows is governed by momentum transfer between the continuous fluid phase and the dispersed particulate phase. When significant temperature differences exist between the fluid and particles and/or chemical reactions take place at the fluid/particle interfaces\, the phases also exchange heat and/or mass\, respectively. While some multi-phase processes may be successfully modelled at the continuum scale through closure approximations\, an increasing number of applications require resolution across scales\, e.g. dense suspensions\, fluidized beds. Within a multi-scale micro/meso/macro-framework\, we develop robust numerical models at the micro and meso scales\, based on a Distributed Lagrange Multiplier/Fictitious Domain method and a two-way Euler/Lagrange method\, respectively. Collisions between finite size particles are modeled with a Discrete Element Method. Many real-life processes and/or flows involve non-spherical particles. Although there is still a lot to learn about flows laden with spherical particles\, there is also a strong incentive to develop new modeling tools to account for non-spherical\, angular\, convex or even non-convex particles. We discuss assorted issues related to the numerical modelling of flows laden with particles of arbitrary shape. Along the way\, we also address high performance computing issues related to our massively parallel numerical tools and challenges to efficiently transfer knowledge from small scales to large scales. We illustrate the modelling capabilities of our tools on the two following problems relevant of applications from the chemical engineering and process industry: (i) a rotating drum filled with non-convex particles and (ii) fixed and fluidized beds of multilobic (and hence non-convex) particles.\n\n  \nThis seminar is co-organized with the Applied Interdisciplinary Mathematics program
URL:https://micde.umich.edu/event/micde-seminar-anthony-wachs-university-of-british-columbia/
LOCATION:1084 East Hall\, 530 Church St.\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:MICDE Seminar Series
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2016/08/Anthony-Wachs.png
GEO:42.2757302;-83.7351764
X-APPLE-STRUCTURED-LOCATION;VALUE=URI;X-ADDRESS=1084 East Hall 530 Church St. Ann Arbor MI 48109 United States;X-APPLE-RADIUS=500;X-TITLE=530 Church St.:geo:-83.7351764,42.2757302
END:VEVENT
BEGIN:VEVENT
DTSTART;TZID=UTC:20161006T154500
DTEND;TZID=UTC:20161006T170000
DTSTAMP:20260604T032813
CREATED:20230905T171441Z
LAST-MODIFIED:20230905T171441Z
UID:10000041-1475768700-1475773200@micde.umich.edu
SUMMARY:MICDE Seminar: Jonathan Freund\, University of Illinois at Urbana-Champaign
DESCRIPTION:Bio: Jonathan Freund is the Donald Biggar Willett Professor of Mechanical Science & Engineering and Aerospace at the University of Illinois at Urbana-Champaign.   He is a Fellow of the American Physical Society\, and a winner of the 2008 Frenkiel Prize from its Division of Fluid Dynamics where he currently serves as the division secretary/treasurer.  He is an associate editor of Physical Review Fluids and on the editorial board of Annual Review of Fluid Mechanics.  Computational science has been central to his research\, which has included simulations of turbulent jet noise and its control\, the dynamics of molecularly thin liquid films\, nanostructure formation by ion-bombardment of semiconductor materials\, and most recently the dynamics of red blood cells flowing in the narrow confines of the microcirculation.  He co-directs the DOE-funded Center for Exascale Simulation of Plasma-Coupled Combustion at the University of Illinois. \nAdjoint-based optimization for understanding and reducing flow noise\nAdvanced simulation tools\, particularly large-eddy simulation techniques\, are becoming capable of making quality predictions of jet noise for realistic nozzle geometries and at engineering relevant flow conditions.  Increasing computer resources will be a key factor in improving these predictions still further.  Quality prediction\, however\, is only a necessary condition for the use of such simulations in design optimization.  Predictions do not of themselves lead to quieter designs.  They must be interpreted or harnessed in some way that leads to design improvements.  As yet\, such simulations have not yielded any simplifying principals that offer general design guidance. The turbulence mechanisms leading to jet noise remain poorly described in their complexity.  In this light\, we have implemented and demonstrated an aeroacoustic adjoint-based optimization technique that automatically calculates gradients that point the direction in which to adjust controls in order to improve designs.  This is done with only a single flow solutions and a solution of an adjoint system\, which is solved at computational cost comparable to that for the flow. Optimization requires iterations\, but having the gradient information provided via the adjoint accelerates convergence in a manner that is insensitive to the number of parameters to be optimized.  The talk will review the formulation of the adjoint of the compressible flow equations for optimizing noise-reducing controls and present examples of its use.  We will particularly focus on some mechanisms of flow noise that have been revealed via this approach. \nThis seminar is co-sponsored by U-M Aerospace Engineering
URL:https://micde.umich.edu/event/micde-seminar-jonathan-freund-university-of-illinois-at-urbana-champaign/
LOCATION:Boeing Auditorium –  1109 Francois-Xavier Bagnoud Building\, 1320 Beal Ave.\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:MICDE Seminar Series
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2016/08/Jonathan-Freund.png
GEO:42.2934378;-83.7118764
X-APPLE-STRUCTURED-LOCATION;VALUE=URI;X-ADDRESS=Boeing Auditorium –  1109 Francois-Xavier Bagnoud Building 1320 Beal Ave. Ann Arbor MI 48109 United States;X-APPLE-RADIUS=500;X-TITLE=1320 Beal Ave.:geo:-83.7118764,42.2934378
END:VEVENT
BEGIN:VEVENT
DTSTART;TZID=UTC:20160929T160000
DTEND;TZID=UTC:20160929T170000
DTSTAMP:20260604T032813
CREATED:20230905T171442Z
LAST-MODIFIED:20230905T171442Z
UID:10000030-1475164800-1475168400@micde.umich.edu
SUMMARY:MICDE Seminar: Jeremy Lichstein\, University of Florida
DESCRIPTION:Bio: Jeremy Lichstein is an assistant professor of Biology at the University of Florida. Professor Lichstein got his Ph. D. from Princeton University and was a postdoctoral research fellow at Princeton’s department of Ecology and Evolutionary Biology. He was the recipient of the University of Florida Excellence Award for Assistant Professor\, and was named a Florida Climate Institute Fellow for 2016-2017. His research interests are forest dynamics\, biodiversity\, carbon cycle and climate change. \nBiodiversity and the changing Earth System: computational challenges and new answers to old questions\nTerrestrial ecosystems currently offset roughly 25% of global annual anthropogenic fossil fuel emissions. However\, the fate of this carbon sink is highly uncertain\, in large part because global models diverge in their predictions of ecosystem responses to climate change\, drought\, and other perturbations. Although there is little agreement on how terrestrial ecosystems will respond to global change on decadal and longer time-scales\, there is wide consensus that current global models are overly simplistic in their representation of important ecological processes. I will discuss our current understanding of how tree functional diversity is maintained in forests\, the consequences of including more realistic levels of functional diversity in global models\, and the computational challenges that need to be overcome in order to introduce ecological realism into the Earth System Models that the scientific and policy communities rely on for climate projections. A key result that is emerging from empirical and theoretical studies is that shifts in species composition across time or space (beta diversity) have different (and sometimes opposite) effects on ecosystem stability as local (alpha) diversity. \nThis seminar is co-sponsored by the U-M department of Ecology and Evolutionary Biology
URL:https://micde.umich.edu/event/micde-2016-fall-seminar-series-jeremy-lichstein-university-of-florida/
LOCATION:1210 Chemistry & Willard H Dow Laboratory\, 930 University Ave.\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:MICDE Seminar Series
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2016/08/Jeremy-Lichstein.png
GEO:42.2780183;-83.7370191
X-APPLE-STRUCTURED-LOCATION;VALUE=URI;X-ADDRESS=1210 Chemistry & Willard H Dow Laboratory 930 University Ave. Ann Arbor MI 48109 United States;X-APPLE-RADIUS=500;X-TITLE=930 University Ave.:geo:-83.7370191,42.2780183
END:VEVENT
BEGIN:VEVENT
DTSTART;TZID=UTC:20160922T160000
DTEND;TZID=UTC:20160922T170000
DTSTAMP:20260604T032813
CREATED:20230905T171442Z
LAST-MODIFIED:20230905T171442Z
UID:10000029-1474560000-1474563600@micde.umich.edu
SUMMARY:MICDE Seminar: Rob Gardner\, University of Chicago
DESCRIPTION:Bio: Robert Gardner is a Senior Scientist at the Computation Institute from the University of Chicago\,  and aSenior Scientist in the Enrico Fermi Institute. He spent his early academic career doing experimental high-energy physics research at different universities in the Midwest. He has been a member of the ATLAS experiment using the Large Hadron Collider at the CERN Laboratory\, Geneva\, Switzerland since 1998. His experimental work led him to specialize in developing and improving distributed computing technologies necessary for discoveries at the frontier of particle physics. He was instrumental in developing early research computing grids in the U.S.: the International Virtual Data Grid Laboratory (iVDGL)\, and the first deployment of the Open Science Grid (OSG) (NSF\, Department of Energy). He have also generated systems for metrics collection for distributed systems (Grid Telemetry\, PI\, NSF-ITR). Currently\, he directs the ATLAS Midwest Tier2 Center\, which is comprised of integrated computing facilities from the University of Chicago\, Indiana University\, and the University of Illinois. \nLeadership cyberinfrastructure for science and the humanities\nIn the past two decades high energy physics transformed its computing model from one relying on a single high performance computing center at the host laboratory to one incorporating resources distributed across institutional boundaries and geographic regions. Given the complexity of detectors and scale of data\, the international collaborations of the Large Hadron Collider at CERN demanded it. By removing barriers to resource sharing\, the resulting data and computation platform democratized the physics process across collaborations. Accelerated modes of scientific discovery by thousands of physicists were forged using hundreds of data centers linked by very high bandwidth networks. Meanwhile the explosion of commercial\, social and enterprise data has driven innovation in resource abstraction and the creation of new service platforms\, offering fresh opportunities to accelerate science and intellectual inquiry at all scales and across all domains. In this talk I’ll discuss the strategic significance that cyberinfrastructure technology plays in this regard and describe models for creating ubiquitous “substrates” that remove obstacles to connecting campuses\, facilities\, instruments and researchers. \nThis seminar is co-sponsored by the U-M department of Physics
URL:https://micde.umich.edu/event/micde-2016-fall-seminar-series-rob-gardner-university-of-chicago/
LOCATION:340 West Hall\, 1085 South University Ave.\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:MICDE Seminar Series
GEO:42.2757556;-83.7362041
X-APPLE-STRUCTURED-LOCATION;VALUE=URI;X-ADDRESS=340 West Hall 1085 South University Ave. Ann Arbor MI 48109 United States;X-APPLE-RADIUS=500;X-TITLE=1085 South University Ave.:geo:-83.7362041,42.2757556
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BEGIN:VEVENT
DTSTART;TZID=UTC:20160913T161000
DTEND;TZID=UTC:20160913T170000
DTSTAMP:20260604T032813
CREATED:20230905T171442Z
LAST-MODIFIED:20230905T171442Z
UID:10000028-1473783000-1473786000@micde.umich.edu
SUMMARY:MICDE Seminar: Nathan Kutz\, University of Washington
DESCRIPTION:Bio: Nathan Kutz is the Robert Bolles and Yasuko Endo Professor in the department of Applied Mathematics\, and an adjunct professor of Electrical Engineering and Physics at the University of Washington. He was awarded the B.S. in Physics and Mathematics from the University of Washington in 1990 and the PhD in Applied Mathematics from Northwestern University in 1994. Following postdoctoral fellowships at the Institute for Mathematics and its Applications (University of Minnesota\, 1994-1995) and Princeton University (1995-1997)\, he joined the faculty of applied mathematics and served as Chair from 2007-2015. \nData-driven discovery of dynamical systems in the engineering\, physical and biological sciences\nWe demonstrate that the integration of data-driven dynamical systems and machine learning strategies with adaptive control are capable of producing efficient and optimal self-tuning algorithms for many complex systems arising in the engineering\, physical and biological sciences. We demonstrate that we can use emerging\, large-scale time-series data from modern sensors to directly construct\, in an adaptive manner\, governing equations\, even nonlinear dynamics\, that best model the system measured using sparsity-promoting techniques. Recent innovations also allow for handling multi-scale physics phenomenon and control protocols in an adaptive and robust way. The overall architecture is equation-free in that the dynamics and control protocols are discovered directly from data acquired from sensors. The theory developed is demonstrated on a number of example problems. Ultimately\, the method can be used to construct adaptive controllers which are capable of obtaining and maintaining optimal states while the machine learning and sparse sensing techniques characterize the system itself for rapid state identification and improved optimization. \nThis seminar is co-sponsored by the U-M Department of Mathematics.
URL:https://micde.umich.edu/event/micde-2016-fall-seminar-series-nathan-kutz-university-of-washington/
LOCATION:1360 East Hall\, 530 Church St.\, Ann Arbor\, MI\, 48109\, United States
CATEGORIES:MICDE Seminar Series
ATTACH;FMTTYPE=image/png:https://micde.umich.edu/wp-content/uploads/2016/08/Nathan-Kutz.png
GEO:42.2757302;-83.7351764
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