The Journal of Physical Chemistry A. Time-Dependent Quantum Molecular Dynamics Workshop, Brian Head, Utah, March 13-17, 1999. Volume 103, Number 47 PDF Download
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Languages : en
Pages : 0
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The proceedings of the workshop on Time Dependent Quantum Molecular Dynamics is presented.
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Languages : en
Pages : 0
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The proceedings of the workshop on Time Dependent Quantum Molecular Dynamics is presented.
Author: Gregory A. Voth
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Languages : en
Pages : 182
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Category : Prosthodontics
Languages : en
Pages : 80
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Author: Mihail C. Roco
Publisher: Springer Science & Business Media
ISBN: 9401703590
Category : Technology & Engineering
Languages : en
Pages : 477
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Book Description
M. C. Roco and W.S. Bainbridge In the early decades of the 21st century, concentrated efforts can unify science based on the unity of nature, thereby advancing the combination of nanotechnology, biotechnology, information technology, and new technologies based in cognitive science. With proper attention to ethical issues and societal needs, converging in human abilities, societal technologies could achieve a tremendous improvement outcomes, the nation's productivity, and the quality of life. This is a broad, cross cutting, emerging and timely opportunity of interest to individuals, society and humanity in the long term. The phrase "convergent technologies" refers to the synergistic combination of four major "NBIC" (nano-bio-info-cogno) provinces of science and technology, each of which is currently progressing at a rapid rate: (a) nanoscience and nanotechnology; (b) biotechnology and biomedicine, including genetic engineering; (c) information technology, including advanced computing and communications; (d) cognitive science, including cognitive neuroscience. Timely and Broad Opportunity. Convergence of diverse technologies is based on material unity at the nanoscale and on technology integration from that scale.
Author: Zehev Tadmor
Publisher: John Wiley & Sons
ISBN: 0470355921
Category : Technology & Engineering
Languages : en
Pages : 1004
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Book Description
Thoroughly revised edition of the classic text on polymer processing The Second Edition brings the classic text on polymer processing thoroughly up to date with the latest fundamental developments in polymer processing, while retaining the critically acclaimed approach of the First Edition. Readers are provided with the complete panorama of polymer processing, starting with fundamental concepts through the latest current industry practices and future directions. All the chapters have been revised and updated, and four new chapters have been added to introduce the latest developments. Readers familiar with the First Edition will discover a host of new material, including: * Blend and alloy microstructuring * Twin screw-based melting and chaotic mixing mechanisms * Reactive processing * Devolatilization--theory, mechanisms, and industrial practice * Compounding--theory and industrial practice * The increasingly important role of computational fluid mechanics * A systematic approach to machine configuration design The Second Edition expands on the unique approach that distinguishes it from comparative texts. Rather than focus on specific processing methods, the authors assert that polymers have a similar experience in any processing machine and that these experiences can be described by a set of elementary processing steps that prepare the polymer for any of the shaping methods. On the other hand, the authors do emphasize the unique features of particular polymer processing methods and machines, including the particular elementary step and shaping mechanisms and geometrical solutions. Replete with problem sets and a solutions manual for instructors, this textbook is recommended for undergraduate and graduate students in chemical engineering and polymer and materials engineering and science. It will also prove invaluable for industry professionals as a fundamental polymer processing analysis and synthesis reference.
Author: Viraht Sahni
Publisher: Springer Science & Business Media
ISBN: 9783540408840
Category : Computers
Languages : en
Pages : 284
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Book Description
Quantal density functional theory (Q-DFT) is a new local effective potential energy theory of the electronic structure of matter. It is a description in terms of classical fields that pervade all space, and their quantal sources. The fields, which are explicitly defined, are separately representative of the many-body electron correlations present in such a description, namely, those due to the Pauli exclusion principle, Coulomb repulsion, correlation-kinetic, and correlation-current-density effects. The book further describes Schrödinger theory from the new perspective of fields and quantal sources. It also explains the physics underlying the functionals and functional derivatives of traditional DFT.
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Publisher: Academic Press
ISBN: 0080582532
Category : Science
Languages : en
Pages : 392
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Book Description
Advances in Quantum Chemistry publishes surveys of current developments in the rapidly developing field of quantum chemistry--a field that falls between the historically established areas of mathematics, physics,chemistry, and biology. With invited reviews written by leading international researchers, each presenting new results, this quality serial provides a single vehicle for following progress in this interdisciplinary area. "Volume 28 collects papers written in honor of Geerd H.F. Diercksen. Diercksen is a pioneer in the field of quantum mechanics whose research includes studies of the structure and stability of hydrogen-bonded and Van der Waals dimers and small clusters, thevibrational and rotational spectra of diatomic and triatomic molecules, on static electric properties in solutions and of molecules absorbed on surfaces. His results are essential in molecular and atomic physics, in astrophysics, and in biochemistry.
Author: National Research Council
Publisher: National Academies Press
ISBN: 0309097029
Category : Technology & Engineering
Languages : en
Pages : 251
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Book Description
Most of the instruments now used for materials research are too complex and expensive for individual investigators to own, operate, and maintain them. Consequently, they have become increasingly consolidated into multi-user, small to midsized research facilities, located at many sites around the country. The proliferation of these facilities, however, has drawn calls for a careful assessment of best principles for their operation. With support from the Department of Energy and the National Science Foundation, the NRC carried out a study to characterize and discuss ways to optimize investments in materials research facility infrastructure with attention to midsize facilities. This report provides an assessment of the nature and importance of mid-sized facilities, their capabilities, challenges they face, current investment, and optimizing their effectiveness.
Author: Jeremiah James
Publisher: Walter de Gruyter
ISBN: 311023954X
Category : Science
Languages : en
Pages : 325
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Book Description
This volume, occasioned by the centenary of the Fritz Haber Institute, formerly the Institute for Physical Chemistry and Electrochemistry, covers the institute's scientific and institutional history from its founding until the present. The institute was among the earliest established by the Kaiser Wilhelm Society, and its inauguration was one of the first steps in the development of Berlin-Dahlem into a center for scientific research. Its establishment was made possible by an endowment from Leopold Koppel, granted on the condition that Fritz Haber, well-known for his discovery of a method to synthesize ammonia from its elements, be made its director. The history of the institute has largely paralleled that of 20th-century Germany. It undertook controversial weapons research during World War I, followed by a "Golden Era" during the 1920s, in spite of financial hardships. Under the National Socialists it experienced a purge of its scientific staff and a diversion of its research into the service of the new regime, accompanied by a breakdown in its international relations. In the immediate aftermath of World War II it suffered crippling material losses, from which it recovered slowly in the post-war era. In 1953, shortly after taking the name of its founding director, the institute joined the fledgling Max Planck Society. During the 1950s and 60s, the institute supported diverse researches into the structure of matter and electron microscopy in a territorially insular and politically precarious West-Berlin. In subsequent decades, as both Berlin and the Max Planck Society underwent significant changes, the institute reorganized around a board of coequal scientific directors and a renewed focus on the investigation of elementary processes on surfaces and interfaces, topics of research that had been central to the work of Fritz Haber and the first "Golden Era" of the institute.
Author: Lisa M. Balbes
Publisher:
ISBN: 9780195183665
Category : Chemistry
Languages : en
Pages : 326
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Book Description
A Chemistry background prepares you for much more than just a laboratory career. The broad science education, analytical thinking, research methods, and other skills learned are of value to a wide variety of types of employers, and essential for a plethora of types of positions. Those who are interested in chemistry tend to have some similar personality traits and characteristics. By understanding your own personal values and interests, you can make informed decisions about what career paths to explore, and identify positions that match your needs. By expanding your options for not only what you will do, but also the environment in which you will do it, you can vastly increase the available employment opportunities, and increase the likelihood of finding enjoyable and lucrative employment. Each chapter in this book provides background information on a nontraditional field, including typical tasks, education or training requirements, and personal characteristics that make for a successful career in that field. Each chapter also contains detailed profiles of several chemists working in that field. The reader gets a true sense of what these people do on a daily basis, what in their background prepared them to move into this field, and what skills, personality, and knowledge are required to make a success of a career in this new field. Advice for people interested in moving into the field, and predictions for the future of that career, are also included from each person profiled. Career fields profiled include communication, chemical information, patents, sales and marketing, business development, regulatory affairs, public policy, safety, human resources, computers, and several others. Taken together, the career descriptions and real case histories provide a complete picture of each nontraditional career path, as well as valuable advice about how career transitions can be planned and successfully achieved by any chemist.
