An Ordering Concept on the Basis of Alternative Principles in Chemistry, R. Boese; Paul Heimbach; R. Budnik; Tamas Bartik;

Автор: C. Gleitzer; J.B. Goodenough; B.G. Hyde; M. O`Keef
Название: Cation Ordering and Electron Transfer
ISBN: 3662152258 ISBN-13(EAN): 9783662152256
Издательство: Springer
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Автор: Akio Teramoto; Masamichi Kobayashi; Takashi Norisu
Название: Ordering in Macromolecular Systems
ISBN: 3642788955 ISBN-13(EAN): 9783642788956
Издательство: Springer
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Описание: This volume summarizes the papers presented at the First Osaka University Macromolecular Symposium OUMS`93 on "Ordering in Macromolecular Systems", which was held at Senri Life Science Center, Osaka, Japan, on June 3 through June 6, 1993.

Автор: A. Yoshimori; M. Tsukada
Название: Dynamical Processes and Ordering on Solid Surfaces
ISBN: 3642824250 ISBN-13(EAN): 9783642824258
Издательство: Springer
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Описание: This volume is the proceedings of the Seventh Taniguchi International Sympo- sium on the Theory of Condensed Matter. The symposium was held for five days from September 10 to 14, 1984 at Kashikojima, Mie, Japan. Dynamical proces- ses and ordering on solid surfaces are the subjects of the symposium. About twenty participants stayed together at Shima Kanko Hotel, the symposium site, during the period. The intense and productive discussion in the bright sea- s ide atmosphere of Kashi koj ima is bel i eved to have been impress i ve to all the participants. Dynamical processes on solid surfaces are the target of recent theoreti- cal efforts in surface physics. Even if some of them are still in their in- fant stage, important aspects begin to appear and vital concepts start to shape themselves. Some topics in the symposium were the energy transfer re- lated with internal degrees of freedom of molecules, attempts to go beyond the trajectory approximati on, charge transfer and energy transfer between particles and solid surfaces, and related fundamental problems like adiaba- tic potentials and electronic structures. In particular, really actively di scussed was the time-dependent Newns-Anderson model wi thout and wi th the intraatomic Coulomb interaction and sometimes with the interaction to the surface plasmons or phonons. Surface effects on the optical processes were discussed with great interest, such as the ABC-related problems of exciton polaritons and rare gas adsorbates on metal surfaces.

Автор: Akio Yoshimori; Teruya Shinjo; Hisatsune Watanabe
Название: Ordering at Surfaces and Interfaces
ISBN: 3642844847 ISBN-13(EAN): 9783642844843
Издательство: Springer
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Описание: This volume contains the proceedings of the third in a series of biennial NEC Symposia on Fundamental Approaches to New Material Phases sponsored by the NEC Corporation, Tokyo, Japan. The symposium was held from October 7 to 11, 1990, at the Hakone Kanko H9tel in Hakone. About 40 invited participants stayed together, became involved in intense discussions, and freely exchanged ideas both in and out of the conference room, which faced Mt. Fuji, the beautiful lake Ashinoko, and the quiet landscape in the old crater. The title of this volume, Ordering at Surfaces and Interfaces, which was also the title of the third symposium, describes the aim of the symposium: to discuss ordering properties and their underlying mechanisms at surfaces and interfaces. The topics treated include the reconstruction of surfaces of semiconductors and metals, atomic and magnetic ordering at interfaces, theoretical tools to study or- dering mechanisms at surfaces and interfaces, ordering in adsorbate-surface sys- tems, such as alkali-adsorbed silicon surfaces, electric current effects on semicon- ductor surfaces and many related STM (scanning tunneling microscopy) results.

Автор: V.P. Gupta
Название: Principles And Applications Of Quantum Chemistry
ISBN: 0128034785 ISBN-13(EAN): 9780128034781
Издательство: Elsevier Science
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Описание: Principles and Applications of Quantum Chemistry offers clear and simple coverage based on the author’s extensive teaching at advanced universities around the globe. Where needed, derivations are detailed in an easy-to-follow manner so that you will understand the physical and mathematical aspects of quantum chemistry and molecular electronic structure. Building on this foundation, this book then explores applications, using illustrative examples to demonstrate the use of quantum chemical tools in research problems. Each chapter also uses innovative problems and bibliographic references to guide you, and throughout the book chapters cover important advances in the field including: Density functional theory (DFT) and time-dependent DFT (TD-DFT), characterization of chemical reactions, prediction of molecular geometry, molecular electrostatic potential, and quantum theory of atoms in molecules.