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The National Science Foundation has identified a new thrust area in Quantum,Molecular and High Performance Modeling and Simulation for Devices and Systems(QMHP) in its core program. The main purpose of this thrust area is to capturescientific opportunities that result from new fundamental cross-cuttingresearch involving three core research communities: (1) experts in modeling andsimulation of electronic devices and systems; (2) high performance computingrelevant to devices and systems; and (3) the quantum many-body principlesrelevant to devices and systems. ECCS is especially interested in learning howwork in these areas could enable whole new classes of systems or devices,beyond what is already under development in existing mainstream research. Theworkshop helped identify technical areas that will enable fundamentalbreakthroughs in the future. Modeling and simulation in the electronics andoptoelectronics areas, in general, have already resulted in importantfundamental scientific understanding and advances in design and development ofdevices and systems. With the increasing emphasis on the next generation ofdevices and systems at the nano, micro, and macro scales and theinterdisciplinary nature of the research, it is imperative that we explore newmathematical models and simulation techniques. This workshop report provides abetter understanding of unmet emerging new opportunities to improve modeling,simulation and design techniques for hybrid devices and systems. The purposethe QMHP workshop was to define the field and strengthen the focus of thethrust. The ultimate goal of the workshop was to produce a final report (thisdocument) that will be posted on the web so that the NSF can use it to guidereviewers and researchers in this field.

Final Report on ECCS/NSF Workshop on Quantum, Molecular and High Performance Modeling and Simulation for Devices and Systems (QMHP)