Product Description: Precedidos por una larga entrevista introductoria, que tiene el valor de una pequena autobiografia cientifica, se recogen aqui dos conferencias recientes de IIya Prigogine sobre uno de los temas centrales de su investigacion cientifica : el tiempo, ya que sobre el funda el autor su conviccion de que nuestra epoca es testigo de una revolucion cientifica cuya importancia es, si no mayor, si en todo caso igual a la copernicana...read more

The use of quantum chemistry for the quantitative prediction of molecular properties has long been frustrated by the technical difficulty of carrying out the needed computations. In the last decade there have been substantial advances in the formalism and computer hardware needed to carry out accurate calculations of molecular properties efficiently. These advances have been sufficient to make quantum chemical calculations a reliable tool for the quantitative interpretation of chemical phenomena and a guide to laboratory experiments. However, the success of these recent developments in computational quantum chemistry is not well known outside the community of practitioners. In order to make the larger community of chemical physicists aware of the current state of the subject, this self-contained volume of Advances in Chemical Physics surveys a number of the recent accomplishments in computational quantum chemistry.This stand-alone work presents the cutting edge of research in computational quantum mechanics. Supplemented with more than 150 illustrations, it provides evaluations of a broad range of methods, including:* Quantum Monte Carlo methods in chemistry* Monte Carlo methods for real-time path integration* The Redfield equation in condensed-phase quantum dynamics* Path-integral centroid methods in quantum statistical mechanics and dynamics* Multiconfigurational perturbation theory-applications in electronic spectroscopy* Electronic structure calculations for molecules containing transition metals* And moreContributors to New Methods in Computational Quantum MechanicsKERSTIN ANDERSSON, Department of Theoretical Chemistry, Chemical Center, SwedenDAVID M. CEPERLEY, National Center for Supercomputing Applications and Department of Physics, University of Illinois at Urbana-Champaign, IllinoisMICHAEL A. COLLINS, Research School of Chemistry, Australian National University, Canberra, AustraliaREINHOLD EGGER, Fakult?t f?r Physik, Universit?t Freiburg, Freiburg, GermanyANTHONY K. FELTS, Department of Chemistry, Columbia University, New YorkRICHARD A. FRIESNER, Department of Chemistry, Columbia University, New YorkMARKUS P. F?LSCHER, Department of Theoretical Chemistry, Chemical Center, SwedenK. M. HO, Ames Laboratory and Department of Physics, Iowa State University, Ames, IowaC. H. MAK, Department of Chemistry, University of Southern California, Los Angeles, CaliforniaPER-?KE Malmqvist, Department of Theoretical Chemistry, Chemical Center, SwedenMANUELA MERCH?n, Departamento de Qu?mica F?sica, Universitat de Val?ncia, SpainLUBOS MITAS, National Center for Supercomputing Applications and Materials Research Laboratory, University of Illinois at Urbana-Champaign, IllinoisSTEFANO OSS, Dipartimento di Fisica, Universit? di Trento and Istituto Nazionale di Fisica della Materia, Unit? di Trento, ItalyKRISTINE PIERLOOT, Department of Chemistry, University of Leuven, BelgiumW. THOMAS POLLARD, Department of Chemistry, Columbia University, New YorkBJ?RN O. ROOS, Department of Theoretical Chemistry, Chemical Center, SwedenLUIS SERRANO-ANDR?S, Department of Theoretical Chemistry, Chemical Center, SwedenPER E. M. SIEGBAHN, Department of Physics, University of Stockholm, Stockholm, SwedenWALTER THIEL, Institut f?r Organische Chemie, Universit?t Z?rich, Z?rich, SwitzerlandGREGORY A. VOTH, Department of Chemistry, University of Pennsylvania, PennsylvaniaC. Z. Wang, Ames Laboratory and Department of Physics, Iowa State University, Ames, Iowa

In Resonances, Instability, and Irreversibility: The Liouville Space Extension of Quantum MechanicsT. Petrosky and I. PrigogineUnstable Systems in Generalized Quantum TheoryE. C. G. Sudarshan, Charles B. Chiu, and G. BhamathiResonances and Dilatation Analyticity in Liouville SpaceErkki J. BrandasTime, Irreversibility, and Unstable Systems in Quantum PhysicsE. Eisenberg and L. P. HorwitzQuantum Systems with Diagonal SingularityI. Antoniou and Z. SuchaneckiNonadiabatic Crossing of Decaying LevelsV. V. and Vl. V. Kocharovsky and S. TasakiCan We Observe Microscopic Chaos in the Laboratory?Pierre GaspardProton Nonlocality and Decoherence in Condensed Matter -- Predictions and Experimental ResultsC. A. Chatzidimitriou-Dreismann"We are at a most interesting moment in the history of science. Classical science emphasized equilibrium, stability, and time reversibility. Now we see instabilities, fluctuations, evolution on all levels of observations. This change of perspective requires new tools, new concepts. This volume invites the reader not to an enumeration of final achievements of contemporary science, but to an excursion to science in the making." --from the Foreword by I. PrigogineWhat are the dynamical roots of irreversibility? How can past and future be distinguished on the fundamental level of description? Are human beings the children of time --or its progenitors? In recent years, a growing number of chemists and physicists have agreed that the solution to the problem of irreversibility requires an extension of classical and quantum mechanics. There is, however, no consensus on which direction this extension should take to include the dynamical description of irreversible processes.Resonances, Instability, and Irreversibility surveys recent attempts --both direct and indirect --to address the problem of irreversibility. Internationally recognized researchers report on their recent studies, which run the gamut from experimental to highly mathematical. The subject matter of these papers falls into three categories: classical systems with emphasis on chaos and dynamical instability, resonances and unstable quantum systems, and the general problem of irreversibility.Presenting the cutting edge of research into some of the most compelling questions that face contemporary chemical physics, Resonances, Instability, and Irreversibility is fascinating reading for professionals and students in every area of the discipline.

The study of surfaces has experienced dramatic growth over the past decade. Now, the editors of the internationally celebrated series Advances in Chemical Physics have brought together in this self-contained, special topic volume contributions from leading researchers in the field treating some of the most crucial aspects of the experimental and theoretical study of surfaces. This work delves into such core issues as:* Kinetics and dynamics of hydrogen adsorption on silicon surfaces.* Potential energy surfaces of transition- metal-catalyzed chemical reactions.* High-resolution helium atom scattering as a proof of surface vibrations.* Ordering and phase transitions in adsorbed monolayers of diatomic molecules.* The influence of dimensionality on static and dynamic properties of a system.* New applications to fields as varied as catalysts and the passage of molecules through membranes.This valuable resource provides important insights into the current state of knowledge about surface properties. Prigogine and Rice's latest work will stimulate the imagination and motivate the exploration of other aspects of this fascinating subject.

The Advances in Chemical Physics series provides the chemical physics and physical chemistry fields with a forum for critical, authoritative evaluations of advances in every area of the discipline. Filled with cutting-edge research reported in a cohesive manner not found elsewhere in the literature, each volume of the Advances in Chemical Physics series serves as the perfect supplement to any advanced graduate class devoted to the study of chemical physics.

The Advances in Chemical Physics series provides the chemical physics and physical chemistry fields with a forum for critical, authoritative evaluations of advances in every area of the discipline. Filled with cutting-edge research reported in a cohesive manner not found elsewhere in the literature, each volume of the Advances in Chemical Physics series serves as the perfect supplement to any advanced graduate class devoted to the study of chemical physics.

Product Description: After discussing the fundamental problems of current science and other philosophic concepts, beginning with controversies between Heraclitus and Parmenides, this book launches into a message of great hope: the future has not been determined...read more

Product Description: Edited by Nobel Prize-winner Ilya Prigogine and renowned authority Stuart A. Rice, the Advances in Chemical Physics series provides a forum for critical, authoritative evaluations in every area of the discipline. In a format that encourages the expression of individual points of view, experts in the field present comprehensive analyses of subjects of interest...read more (view table of contents, read Amazon.com's description)

Since the first attempts to model proteins on a computer began almost thirty years ago, our understanding of protein structure and dynamics has dramatically increased. Spectroscopic measurement techniques continue to improve in resolution and sensitivity, allowing a wealth of information to be obtained with regard to the kinetics of protein folding and unfolding, and complementing the detailed structural picture of the folded state. Concurrently, algorithms, software, and computational hardware have progressed to the point where both structural and kinetic problems may be studied with a fair degree of realism. Despite these advances, many major challenges remain in understanding protein folding at both the conceptual and practical levels.Computational Methods for Protein Folding seeks to illuminate recent advances in computational modeling of protein folding in a way that will be useful to physicists, chemists, and chemical physicists. Covering a broad spectrum of computational methods and practices culled from a variety of research fields, the editors present a full range of models that, together, provide a thorough and current description of all aspects of protein folding. A valuable resource for both students and professionals in the field, the book will be of value both as a cutting-edge overview of existing information and as a catalyst for inspiring new studies.Computational Methods for Protein Folding is the 120th volume in the acclaimed series Advances in Chemical Physics, a compilation of scholarly works dedicated to the dissemination of contemporary advances in chemical physics, edited by Nobel Prize-winner Ilya Prigogine.

Product Description: This book helps managers and investment analysts understand the value of analyzing the long-run growth processes of corporations. The authors develop an approach for analyzing and modeling the productivity growth of individual corporations and show the importance of corporate culture in determining firm performance in the long-run...read more (view table of contents, read Amazon.com's description)

Product Description: The role of chaos in science and mathematics is examined in detail by the essays that comprise this work. Distinguished scholars specializing in mathematics, physics, and chemistry discuss the following subjects: Fractals, by Benoit Mandelbrot; The Causality Principle, Deterministic Laws and Chaos, by Heinz-Otto Peitgen; The Transition to Chaos, by Mitchell Feigenbaum; Time, Dynamics and Chaos: Integrating Poincare's 'Non-Integrable Systems', by Ilya Prigogine; What Is Chaos, by Steve Smale; Chaos and Cosmos: A Theological Approach, by John Polkinghorne; and Chaos and Beyond, by James Gleick...read more

Product Description: The role of chaos in science and mathematics is examined in detail by the essays that comprise this work. Distinguished scholars specializing in mathematics, physics, and chemistry discuss the following subjects: Fractals, by Benoit Mandelbrot; The Causality Principle, Deterministic Laws and Chaos, by Heinz-Otto Peitgen; The Transition to Chaos, by Mitchell Feigenbaum; Time, Dynamics and Chaos: Integrating Poincare's 'Non-Integrable Systems', by Ilya Prigogine; What Is Chaos, by Steve Smale; Chaos and Cosmos: A Theological Approach, by John Polkinghorne; and Chaos and Beyond, by James Gleick...read more

Product Description: The aim of this series is to help the reader obtain general information about a wide variety of topics in the broad field of chemical physics. Experts present analyses of subjects of interest to stimulate new research and encourage the expression of individual points of view. (view table of contents, read Amazon.com's description)

Product Description: Unexpected discoveries in nonequilibrium physics and nonlinear dynamics are changing our understanding of complex phenomena. Recent research has revealed fundamental new properties of matter in far-from-equilibrium conditions, and the prevalence of instability-where small changes in initial conditions may lead to amplified effects...read more