Applied Many-Body Methods in Spectroscopy and Electronic Structure
There has been a steady advance of the atomic and molecular many-body methodology over the last few years, with a concomitant development of versatile computer codes. Understanding and interpretation of electronic structural features and the associated sp
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Applied Many-Body Methods in Spectroscopy and Electronic Structure
Edited by
Debashis Mukherjee Indian Association for the Cultivation of Science Calcutta, India
SPRINGER SCIENCE+BUSINESS MEDIA, LLC
Library of Congress Cataloging in Publication Data Applied many-body methods in spectroscopy and electronic structure I edited by Debashis Mukherjee. em. p. Includes bibliographical references and index. ISBN 978-1-4757-9258-4 ISBN 978-1-4757-9256-0 (eBook) DOI 10.1007/978-1-4757-9256-0 1. Spectrum analysis. 2. Electronic structure. 3. Many-body problem. 4. Chemistry, Physical and theoretical. I. Mukherjee, D. (Debashis), date. 92-3802 QC451.A661992 CIP 535.8'4-dc20
Proceedings of a symposium on Applied Many-Body Methods in Spectroscopy and Electronic Structure, held December 10-12, 1990, in Calcutta, India
ISBN 978-1-4757-9258-4 © 1992 Springer Science+Business Media New York Originally published by Plenum Press, New York in 1992 Softcover reprint of the hardcover 1st edition 1992 All rights reserved No part of this book may be reproduced, stored in a retrieval system, or transmitted in any form or by any means, electronic, mechanical, photocopying, microfilming, recording, or otherwise, without written permission from the Publisher
FOREWORD
There has been a steady advance of the atomic and molecular many-body methodology over the last few years, with a concomitant development of versatile computer codes. Understanding and interpretation of electronic structural features and the associated spectroscopic properties via many-body techniques are becoming competitive with those obtained with the traditional formalisms. Since the many-body techniques are not yet a part of the repertoire of the "black-box tools" of electronic structure and spectroscopy, it seems worthwhile to take stock now of the recent progress in certain selected areas. The present volume is more in the nature of proceedings of a "Paper Symposium," rather than of one which actually took place. We did organize in Calcutta, between December 10 and 12, 1990, a small meeting on Applied Many-Body Methods to Spectroscopy and Electronic Structure, jointly organized by the Indian Association for the Cultivation of Science and the S.N. Bose National Centre for Basic Sciences. Several leading practitioners were invited, among which some could not come for various reasons. We later decided to publish a volume of a more enhanced scope and invited other experts as well to contribute papers on topics which are related in spirit with the coverage of the meeting. The volume embodies such diverse topics as a modern pedagogical survey of the Bruckner-Goldstone theory, recent progress in the Propagator theories (Multiconfiguration Propagator theories, Algebraic Diagrammatic Construction and studies on photoionization cross-section), Coupled-Cluster approaches to the parity non-conserving processes, Complex Scaling methods for atomic and molecular resonances and other nonstationary states, and recent developments of Effective Hamiltonian formalisms in the framewor