@BOOK{NAP title = "Consolidated Index of Selected Property Values: Physical Chemistry and Thermodynamics", url = "https://nap.nationalacademies.org/catalog/20242/consolidated-index-of-selected-property-values-physical-chemistry-and-thermodynamics", year = 1962, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP author = "National Research Council", title = "The Future of U.S. Chemistry Research: Benchmarks and Challenges", isbn = "978-0-309-10533-0", abstract = "Chemistry plays a key role in conquering diseases, solving energy problems, addressing\nenvironmental problems, providing the discoveries that lead to new industries, and developing new materials and technologies for national defense and homeland security. However, the field is currently facing a crucial time of change and is struggling to position itself to meet the needs of the future as it expands beyond its traditional core toward areas related to biology, materials science, and nanotechnology.\n\nAt the request of the National Science Foundation and the U.S. Department\nof Energy, the National Research Council conducted an in-depth benchmarking analysis to gauge the current standing of the U.S. chemistry field in the world. The Future of U.S. Chemistry Research: Benchmarks and Challenges highlights the main findings of the benchmarking exercise.\n", url = "https://nap.nationalacademies.org/catalog/11866/the-future-of-us-chemistry-research-benchmarks-and-challenges", year = 2007, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP author = "National Research Council", title = "Physical Oceanography and Tracer Chemistry of the Southern Ocean: Polar Research - A Strategy", url = "https://nap.nationalacademies.org/catalog/19111/physical-oceanography-and-tracer-chemistry-of-the-southern-ocean-polar", year = 1988, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP title = "Marine Chemistry: A Report", url = "https://nap.nationalacademies.org/catalog/20458/marine-chemistry-a-report", year = 1971, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP title = "Permafrost: North American Contribution", url = "https://nap.nationalacademies.org/catalog/20223/permafrost-north-american-contribution", year = 1973, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP title = "Needs and Opportunities for the National Resource for Computation in Chemistry (NRCC): Report of a Workshop", url = "https://nap.nationalacademies.org/catalog/19954/needs-and-opportunities-for-the-national-resource-for-computation-in-chemistry-nrcc", year = 1976, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP title = "Third Report of the Committee on Contact Catalysis (Published in the Journal of Physical Chemistry): Reprint and Circular Series of the National Research Council", url = "https://nap.nationalacademies.org/catalog/9561/third-report-of-the-committee-on-contact-catalysis-published-in-the-journal-of-physical-chemistry", year = 1924, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP title = "Technology Commercialization: Russian Challenges, American Lessons", isbn = "978-0-309-06194-0", abstract = "This collection of papers\u2014by American and Russian specialists\u2014addresses a variety of legal, regulatory, institutional, and financial issues that can promote or hinder technology commercialization. The book is the result of a series of workshops organized by the National Research Council with the Russian Academy of Sciences on commercialization of technologies, particularly those developed at research and educational institutions.\nTechnology Commercialization concludes with a list of actions, programs, and policies which warrant further consideration as Russia tries to improve the success of technology commercialization. This book will be of interest to those concerned with small-business development in post-communist states, university technology management, and comparative technology commercialization.", url = "https://nap.nationalacademies.org/catalog/6378/technology-commercialization-russian-challenges-american-lessons", year = 1998, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP author = "National Research Council", title = "Report of the Committee on Proposal Evaluation for Allocation of Supercomputing Time for the Study of Molecular Dynamics: Fourth Round", isbn = "978-0-309-29278-8", abstract = "This letter report evaluates proposals for allocation of time to the non-commercial research community on Anton, a supercomputer specially designed and built by D.E. Shaw Research (DESRES) that allows for dramatically increased molecular dynamics simulations compared to other currently available resources. Over the past three years (October 1, 2010 \u00e2\u20ac\u201c September 30, 2013), DESRES has made available to the non-commercial research community node-hours on an Anton system housed at the Pittsburgh Supercomputing Center (PSC), based on the advice of previous National Research Council committees convened in 2010, 2011, and 2012.", url = "https://nap.nationalacademies.org/catalog/18503/report-of-the-committee-on-proposal-evaluation-for-allocation-of-supercomputing-time-for-the-study-of-molecular-dynamics", year = 2013, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP author = "National Academies of Sciences, Engineering, and Medicine", title = "Report of the Committee on Proposal Evaluation for Allocation of Supercomputing Time for the Study of Molecular Dynamics: Sixth Round", abstract = "This report describes the work of the Committee on Proposal Evaluation for Allocation of Supercomputing Time for the Study of Molecular Dynamics, Sixth Round. The committee evaluated submissions received in response to a Request for Proposals (RFP) for biomolecular simulation time on Anton, a supercomputer specially designed and built by D.E. Shaw Research (DESRES). Over the past five years, DESRES has made an Anton system housed at the Pittsburgh Supercomputing Center (PSC) available to the non-commercial research community, based on the advice of previous National Research Council committees. As in prior rounds, the goal of the sixth RFP for simulation time on Anton is to continue to facilitate breakthrough research in the study of biomolecular systems by providing a massively parallel system specially designed for molecular dynamics simulations. The program seeks to continue to support research that addresses important and high impact questions demonstrating a clear need for Anton's special capabilities.\nReport of the Committee on Proposal Evaluation for Allocation of Supercomputing Time for the Study of Molecular Dynamics, Sixth Round is the report of the committee's evaluation of proposals based on scientific merit, justification for requested time allocation, and investigator qualifications and past accomplishments. This report identifies the proposals that best met the selection criteria.", url = "https://nap.nationalacademies.org/catalog/21817/report-of-the-committee-on-proposal-evaluation-for-allocation-of-supercomputing-time-for-the-study-of-molecular-dynamics", year = 2015, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP author = "National Research Council", title = "Review and Assessment of the Proposals for Design and Operation of Designated Chemical Agent Destruction Pilot Plants (DCAPP-Blue Grass II): Letter Report", abstract = "In 2002, the Army asked for proposals for a full-scale pilot plant to destroy chemical weapons at the Pueblo Chemical Depot and, in 2003, for a similar plant for the Blue Grass Army Depot. In both cases, the initial designs proved to be too costly, and redesigns were requested. At the same time, the Army asked the NRC to form committees to review and assess these proposals. This report focuses on the technical aspects, maturity, and schedule for the proposed full intermediate design for the Blue Grass facility, less the supercritical water oxidation process, which was reviewed in a previous report.", url = "https://nap.nationalacademies.org/catalog/11715/review-and-assessment-of-the-proposals-for-design-and-operation-of-designated-chemical-agent-destruction-pilot-plants-dcapp-blue-grass-ii", year = 2006, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP author = "National Academy of Sciences", title = "Biographical Memoirs: Volume 65", isbn = "978-0-309-07359-2", abstract = "Biographic Memoirs: Volume 65 contains the biographies of deceased members of the National Academy of Sciences and bibliographies of their published works. Each biographical essay was written by a member of the Academy familiar with the professional career of the deceased. For historical and bibliographical purposes, these volumes are worth returning to time and again.", url = "https://nap.nationalacademies.org/catalog/4548/biographical-memoirs-volume-65", year = 1994, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP author = "National Research Council", title = "Spatial Statistics and Digital Image Analysis", isbn = "978-0-309-04376-2", abstract = "Spatial statistics is one of the most rapidly growing areas of statistics, rife with fascinating research opportunities. Yet many statisticians are unaware of those opportunities, and most students in the United States are never exposed to any course work in spatial statistics. Written to be accessible to the nonspecialist, this volume surveys the applications of spatial statistics to a wide range of areas, including image analysis, geosciences, physical chemistry, and ecology.\nThe book describes the contributions of the mathematical sciences, summarizes the current state of knowledge, and identifies directions for research.", url = "https://nap.nationalacademies.org/catalog/1783/spatial-statistics-and-digital-image-analysis", year = 1991, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP title = "Report of the Committee on Proposal Evaluation for Allocation of Supercomputing Time for the Study of Molecular Dynamics: Third Round", abstract = "The committee evaluated submissions received in response to a request for proposals (RFP) for Biomolecular Simulation Time on Anton, a supercomputer specially designed and built by D.E. Shaw Research (DESRES) that allows for dramatically increased molecular dynamics simulations compared to other currently available resources. During the past 2 years, DESRES has made available to the non-commercial research community node-hours on an Anton system housed at the Pittsburgh Supercomputing Center (PSC), based on the advice of previous National Research Council committees convened in the falls of 2010 and 2011.\nThe success of the program has left DESRES to make the Anton machine housed at the PSC available for an additional 3.7 million node-hours during the 9 months following October 2012. DESRES has asked the National Research Council (NRC) to once again facilitate the allocation of time to the non-commercial research community. To undertake this task, the NRC convened a committee of experts to evaluate the proposals submitted in response to the aforementioned RFP. The committee members were selected for their expertise in molecular dynamics simulations, as well as their experience in the subject areas represented in the 52 proposals that were considered by the committee. They comprised a cross-section of the biomolecular dynamics field in academia, industry, and government, including an array of both senior and junior investigators.\nThe goal of the third RFP for Biomolecular Simulation Time on Anton has been to continue to facilitate breakthrough research in the study of biomolecular systems by providing a massively parallel system specially designed for molecular dynamics simulations. These special capabilities allow multi-microsecond to millisecond simulation timescales, which previously had been unobtainable. The program seeks to continue to support research that addresses important and high-impact questions demonstrating a clear need for Anton's special capabilities.Report of the Committee on Proposal Evaluation for Allocation of Supercomputing Time for the Study of Molecular Dynamics: Third Round is a summary of the proposals, research, and criteria set forth in the RFP for Biomolecular Simulation Time on Anton.", url = "https://nap.nationalacademies.org/catalog/14671/report-of-the-committee-on-proposal-evaluation-for-allocation-of-supercomputing-time-for-the-study-of-molecular-dynamics", year = 2012, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP author = "National Research Council", title = "Review and Assessment of Proposals for Chemical Agent Destruction Pilot Plant at Pueblo, Colorado: Letter Report", url = "https://nap.nationalacademies.org/catalog/11236/review-and-assessment-of-proposals-for-chemical-agent-destruction-pilot-plant-at-pueblo-colorado", year = 2005, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP author = "National Research Council", title = "Review and Assessment Program Options for Chemical Agent Destruction Pilot Plants at Blue Grass: Letter Report", url = "https://nap.nationalacademies.org/catalog/11330/review-and-assessment-program-options-for-chemical-agent-destruction-pilot-plants-at-blue-grass", year = 2005, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP author = "National Academies of Sciences, Engineering, and Medicine", title = "Advancing Chemistry and Quantum Information Science: An Assessment of Research Opportunities at the Interface of Chemistry and Quantum Information Science in the United States", isbn = "978-0-309-69809-2", abstract = "The field of quantum information science (QIS) has witnessed a dramatic rise in scientific research activities in the 21st century as excitement has grown about its potential to revolutionize communications and computing, strengthen encryption, and enhance quantum sensing, among other applications. While, historically, QIS research has been dominated by the field of physics and computer engineering, this report explores how chemistry - in particular the use of molecular qubits - could advance QIS. In turn, researchers are also examining how QIS could be used to solve problems in chemistry, for example, to facilitate new drug and material designs, health and environmental monitoring tools, and more sustainable energy production.\nRecognizing that QIS could be a disruptive technology with the potential to create groundbreaking products and new industries, Advancing Chemistry and Quantum Information Science calls for U.S. leadership to build a robust enterprise to facilitate and support research at the intersection of chemistry and QIS. This report identifies three key research areas: design and synthesis of molecular qubit systems, measurement and control of molecular quantum systems, and experimental and computational approaches for scaling qubit design and function. Advancing Chemistry and Quantum Information Science recommends that the Department of Energy, National Science Foundation, and other funding agencies should support multidisciplinary and collaborative research in QIS, the development of new instrumentation, and facilities, centralized and open-access databases, and efforts to create a more diverse and inclusive chemical workforce.", url = "https://nap.nationalacademies.org/catalog/26850/advancing-chemistry-and-quantum-information-science-an-assessment-of-research", year = 2023, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP title = "Report of the Committee on Battery Additives of the National Academy of Sciences", url = "https://nap.nationalacademies.org/catalog/27377/report-of-the-committee-on-battery-additives-of-the-national-academy-of-sciences", year = 1953, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP author = "National Research Council", title = "Report of the Committee on Proposal Evaluation for Allocation of Supercomputing Time for the Study of Molecular Dynamics", abstract = "This letter details the work and transmits the final report of the Committee on Proposal Evaluation for Allocation of Supercomputing Time for the Study of Molecular Dynamics. The committee evaluated submissions in response to a Request for Proposals (RFP) for Biomolecular Simulation Time on Anton, a specialized supercomputer designed and constructed by D.E. Shaw Research that allows for dramatically accelerated molecular dynamics simulations. D.E. Shaw is making time on a 512 node Anton machine available to the non-commercial research community without cost. The goal of the RFP for Biomolecular Simulation Time on Anton is to facilitate breakthrough science in the study of biomolecular systems by providing access to a dedicated, massively parallel supercomputer that allows significantly faster simulations of biomolecular systems using periodic boundary conditions and explicit solvent models. Anton's capabilities allow questions to be addressed on multi-microsecond simulation timescales, so the program seeks to support projects addressing important and potentially high impact questions that would be most advanced by receiving time on this specialized machine.", url = "https://nap.nationalacademies.org/catalog/13003/report-of-the-committee-on-proposal-evaluation-for-allocation-of-supercomputing-time-for-the-study-of-molecular-dynamics", year = 2010, publisher = "The National Academies Press", address = "Washington, DC" } @BOOK{NAP author = "National Research Council", title = "Review of Physical Science Proposals to the State of Ohio's 2005 Wright Centers of Innovation Award Program: Final Letter Report", url = "https://nap.nationalacademies.org/catalog/11306/review-of-physical-science-proposals-to-the-state-of-ohios-2005-wright-centers-of-innovation-award-program", year = 2005, publisher = "The National Academies Press", address = "Washington, DC" }