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Book Theoretical and Quantum Chemistry at the Dawn of the 21st Century

Download or read book Theoretical and Quantum Chemistry at the Dawn of the 21st Century written by Tanmoy Chakraborty and published by CRC Press. This book was released on 2018-06-19 with total page 635 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume, edited by a well-known specialist in the field of theoretical chemistry, gathers together a selection of papers on theoretical chemistry within the themes of mathematical, computational, and quantum chemistry. The authors present a rich assembly of some of the most important current research in the field of quantum chemistry in modern times. In Quantum Chemistry at the Dawn of the 21st Century, the editors aim to replicate the tradition of the fruitful Girona Workshops and Seminars, held at the University of Girona, Italy, annually for many years, which offered important scientific gatherings focusing on quantum chemistry. This volume, like the workshops, showcases a large variety of quantum chemical contributions from different points of view from some of the leading scientists in the field today. This unique volume does not pretend to provide a complete overview of quantum chemistry, but it does provide a broad set of contributions by some of the leading scientists on the field, under the expert editorship of two leaders in the field.

Book Visions of Discovery

    Book Details:
  • Author : Raymond Y. Chiao
  • Publisher : Cambridge University Press
  • Release : 2011
  • ISBN : 0521882397
  • Pages : 827 pages

Download or read book Visions of Discovery written by Raymond Y. Chiao and published by Cambridge University Press. This book was released on 2011 with total page 827 pages. Available in PDF, EPUB and Kindle. Book excerpt: World-leading researchers, including Nobel Laureates, explore the most basic questions of science, philosophy, and the nature of existence.

Book Martians of Science

Download or read book Martians of Science written by Istvan Hargittai and published by Oxford University Press. This book was released on 2006-07-27 with total page 370 pages. Available in PDF, EPUB and Kindle. Book excerpt: If science has the equivalent of a Bloomsbury group, it is the five men born at the turn of the twentieth century in Budapest: Theodore von Kármán, Leo Szilard, Eugene Wigner, John von Neumann, and Edward Teller. From Hungary to Germany to the United States, they remained friends and continued to work together and influence each other throughout their lives. As a result, their work was integral to some of the most important scientific and political developments of the twentieth century. István Hargittai tells the story of this remarkable group: Wigner won a Nobel Prize in theoretical physics; Szilard was the first to see that a chain reaction based on neutrons was possible, initiated the Manhattan Project, but left physics to try to restrict nuclear arms; von Neumann could solve difficult problems in his head and developed the modern computer for more complex problems; von Kármán became the first director of NASA's Jet Propulsion Laboratory, providing the scientific basis for the U.S. Air Force; and Teller was the father of the hydrogen bomb, whose name is now synonymous with the controversial "Star Wars" initiative of the 1980s. Each was fiercely opinionated, politically active, and fought against all forms of totalitarianism. Hargittai, as a young Hungarian physical chemist, was able to get to know some of these great men in their later years, and the depth of information and human interest in The Martians of Science is the result of his personal relationships with the subjects, their families, and their contemporaries.

Book Optical  Electric and Magnetic Properties of Molecules

Download or read book Optical Electric and Magnetic Properties of Molecules written by D.C. Clary and published by Elsevier. This book was released on 1997-06-19 with total page 363 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book celebrates the career and scientific accomplishments of Professor David Buckingham, who is due to retire from his Chair at Cambridge University in 1997. The adopted format comprises reprints of a number of David Buckingham's key scientific papers, each one or two of these preceded by a review of the corresponding area of David's wide-ranging research interest. Each reviewer is recognised as an expert in that field of interest and has some close association with David Buckingham, as a scientific colleague and/or a former research student. The book should serve as a distinctive reference source, both retrospective and prospective, for the field of chemical physics with which the name A.D. Buckingham is associated.The editors opted to reprint a majority of early classic Buckingham papers, balanced by some of David Buckingham's more recent publications. Reprinted papers have been placed into a general scientific context that covers prior influences on, and later impacts by, the work nominated for review.

Book Chemistry  Quantum Mechanics and Reductionism

Download or read book Chemistry Quantum Mechanics and Reductionism written by H. Primas and published by Springer Science & Business Media. This book was released on 2013-11-11 with total page 468 pages. Available in PDF, EPUB and Kindle. Book excerpt: The purpose of this book is to provide a deeper insight into the modern theories of molecular matter. It incorporates the most important developments which have taken place during the last decades and reflects the modern trend to abstraction. At the present state of the art we have acquired a fairly good knowledge of "how to. compute" small molecules us ing the methods of quantum chemistry. Yet, in spite of many statements to the contrary and many superficial discussions, the theoretical basis of chemistry and biology is not safely in our hands. It is all but impossible to summarize the modern developments of the theory of matter in nontechnical language. But I hope that I can give some feeling for the problems, the intellectual excitements and the wor ries of some theoreticians. I know very well that such an enterprise is a dangerous adventure and that one says that a clever scientist should take care of his reputation by barricading himself behind the safe wall of his speciality. This volume is not meant to be a textbook; in many respects it has complementary goals. For good and bad reasons, most textbooks ignore the historical and philosophical aspects and go ahead on the basis of crude simplifications; many even lie like the devil and do not shrink from naive indoctrination. Some sections of this book can be read as commentaries on our standard texts, they are intended to stir the waters with controversy.

Book Theoretical Chemistry

Download or read book Theoretical Chemistry written by Winfred Oliver Milligan and published by . This book was released on 1973 with total page 314 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Book Judging Edward Teller

Download or read book Judging Edward Teller written by Istvan Hargittai and published by Prometheus Books. This book was released on 2010-12-31 with total page 575 pages. Available in PDF, EPUB and Kindle. Book excerpt: A personal acquaintance of Teller's presents the definitive, balanced portrait of the scientist against the backdrop of a turbulent period of history, and reveals the contradictory nature of this complex man in all his strengths, flaws, and brilliance.

Book Theoretical Chemistry and Physics of Heavy and Superheavy Elements

Download or read book Theoretical Chemistry and Physics of Heavy and Superheavy Elements written by U. Kaldor and published by Springer Science & Business Media. This book was released on 2013-06-29 with total page 580 pages. Available in PDF, EPUB and Kindle. Book excerpt: Quantum mechanics provides the fundamental theoretical apparatus for describing the structure and properties of atoms and molecules in terms of the behaviour of their fundamental components, electrons and nudeL For heavy atoms and molecules containing them, the electrons can move at speeds which represent a substantial fraction of the speed of light, and thus relativity must be taken into account. Relativistic quantum mechanics therefore provides the basic formalism for calculating the properties of heavy-atom systems. The purpose of this book is to provide a detailed description of the application of relativistic quantum mechanics to the many-body prob lem in the theoretical chemistry and physics of heavy and superheavy elements. Recent years have witnessed a continued and growing interest in relativistic quantum chemical methods and the associated computa tional algorithms which facilitate their application. This interest is fu elled by the need to develop robust, yet efficient theoretical approaches, together with efficient algorithms, which can be applied to atoms in the lower part of the Periodic Table and, more particularly, molecules and molecular entities containing such atoms. Such relativistic theories and computational algorithms are an essential ingredient for the description of heavy element chemistry, becoming even more important in the case of superheavy elements. They are destined to become an indispensable tool in the quantum chemist's armoury. Indeed, since relativity influences the structure of every atom in the Periodic Table, relativistic molecular structure methods may replace in many applications the non-relativistic techniques widely used in contemporary research.

Book Edward Teller Centennial Symposium

Download or read book Edward Teller Centennial Symposium written by Stephen B. Libby and published by World Scientific. This book was released on 2010 with total page 177 pages. Available in PDF, EPUB and Kindle. Book excerpt: This proceedings volume, for the symposium in honor of Edward Teller's 100th anniversary, focuses on Teller's scientific legacy. This legacy includes some of the most fundamental insights into the quantum behaviors of molecules, nuclei, surfaces, solid state and spin systems and plasmas. Many of these are ?brand names? from the canon of 20th-century physics and chemistry, such as Gamow?Teller transitions, the Jahn?Teller effect, Goldhaber?Teller resonances, the Lyddane?Sachs?Teller relation, the Brunauer?Emmett?Teller equation of state, and the MR2T2 algorithm. All of these have had a profound and continuing impact on science ? as has Teller's work on level crossing, diamagnetism, and plasma and statistical physics. The legacies of these discoveries are discussed in this volume, as is Teller's role in applied science and education.

Book Edward Teller Centennial Symposium  Modern Physics And The Scientific Legacy Of Edward Teller  With Dvd rom

Download or read book Edward Teller Centennial Symposium Modern Physics And The Scientific Legacy Of Edward Teller With Dvd rom written by Stephen B Libby and published by World Scientific. This book was released on 2010-01-13 with total page 177 pages. Available in PDF, EPUB and Kindle. Book excerpt: This proceedings volume, for the symposium in honor of Edward Teller's 100th anniversary, focuses on Teller's scientific legacy. This legacy includes some of the most fundamental insights into the quantum behaviors of molecules, nuclei, surfaces, solid state and spin systems and plasmas. Many of these are “brand names” from the canon of 20th-century physics and chemistry, such as Gamow-Teller transitions, the Jahn-Teller effect, Goldhaber-Teller resonances, the Lyddane-Sachs-Teller relation, the Brunauer-Emmett-Teller equation of state, and the MR2T2 algorithm. All of these have had a profound and continuing impact on science — as has Teller's work on level crossing, diamagnetism, and plasma and statistical physics. The legacies of these discoveries are discussed in this volume, as is Teller's role in applied science and education.

Book Correlations in Condensed Matter under Extreme Conditions

Download or read book Correlations in Condensed Matter under Extreme Conditions written by G. G. N. Angilella and published by Springer. This book was released on 2017-03-30 with total page 401 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book addresses a wide range of topics relating to the properties and behavior of condensed matter under extreme conditions such as intense magnetic and electric fields, high pressures, heat and cold, and mechanical stresses. It is divided into four sections devoted to condensed matter theory, molecular chemistry, theoretical physics, and the philosophy and history of science. The main themes include electronic correlations in material systems under extreme pressure and temperature conditions, surface physics, the transport properties of low-dimensional electronic systems, applications of the density functional theory in molecular systems, and graphene. The book is the outcome of a workshop held at the University of Catania, Italy, in honor of Professor Renato Pucci on the occasion of his 70th birthday. It includes selected invited contributions from collaborators and co-authors of Professor Pucci during his long and successful career, as well as from other distinguished guest authors.

Book Solved and Unsolved Problems of Structural Chemistry

Download or read book Solved and Unsolved Problems of Structural Chemistry written by Milan Randic and published by CRC Press. This book was released on 2016-04-21 with total page 482 pages. Available in PDF, EPUB and Kindle. Book excerpt: Solved and Unsolved Problems of Structural Chemistry introduces new methods and approaches for solving problems related to molecular structure. It includes numerous subjects such as aromaticity-one of the central themes of chemistry-and topics from bioinformatics such as graphical and numerical characterization of DNA, proteins, and proteomes. It a

Book Local Density Approximations in Quantum Chemistry and Solid State Physics

Download or read book Local Density Approximations in Quantum Chemistry and Solid State Physics written by Jens Peder Dahl and published by Springer Science & Business Media. This book was released on 2013-11-11 with total page 848 pages. Available in PDF, EPUB and Kindle. Book excerpt: The· simplest picture of an atom, a molecule or a solid is the picture of its distribution of charge. It is obtained by specifying the positions of the atomic nuclei and by showing how the density, p(E), of the electronic charge-cloud varies from place to place. A much more detailed picture is provided by the many-electron wavefunction. This quantity shows not only the arrangement of the electrons with respect to the nuclei, but also the arrangement of the electrons with respect to each other, and it allows the evaluation of the total energy and other properties. The many-electron wavefunction is in principle obtained by solving the many-electron Schrodinger equation for the motion of the interacting electrons under the influ ence of the nuclei, but in practice the equation is unsolvable, and it is necessary to proceed by methods of approximation. Needless to say, .such methods will as a rule depend on the complexity of the system considered.

Book Textbook of Polymer Science

Download or read book Textbook of Polymer Science written by Fred W. Billmeyer and published by John Wiley & Sons. This book was released on 1984-03-21 with total page 598 pages. Available in PDF, EPUB and Kindle. Book excerpt: This Third Edition of the classic, best-selling polymer science textbook surveys theory and practice of all major phases of polymer science, engineering, and technology, including polymerization, solution theory, fractionation and molecular-weight measurement, solid-state properties, structure-property relationships, and the preparation, fabrication and properties of commercially-important plastics, fibers, and elastomers.

Book Cathedrals of Science

    Book Details:
  • Author : Patrick Coffey
  • Publisher : Oxford University Press
  • Release : 2008-08-29
  • ISBN : 0199886547
  • Pages : 400 pages

Download or read book Cathedrals of Science written by Patrick Coffey and published by Oxford University Press. This book was released on 2008-08-29 with total page 400 pages. Available in PDF, EPUB and Kindle. Book excerpt: In Cathedrals of Science, Patrick Coffey describes how chemistry got its modern footing-how thirteen brilliant men and one woman struggled with the laws of the universe and with each other. They wanted to discover how the world worked, but they also wanted credit for making those discoveries, and their personalities often affected how that credit was assigned. Gilbert Lewis, for example, could be reclusive and resentful, and his enmity with Walther Nernst may have cost him the Nobel Prize; Irving Langmuir, gregarious and charming, "rediscovered" Lewis's theory of the chemical bond and received much of the credit for it. Langmuir's personality smoothed his path to the Nobel Prize over Lewis. Coffey deals with moral and societal issues as well. These same scientists were the first to be seen by their countries as military assets. Fritz Haber, dubbed the "father of chemical warfare," pioneered the use of poison gas in World War I-vividly described-and Glenn Seaborg and Harold Urey were leaders in World War II's Manhattan Project; Urey and Linus Pauling worked for nuclear disarmament after the war. Science was not always fair, and many were excluded. The Nazis pushed Jewish scientists like Haber from their posts in the 1930s. Anti-Semitism was also a force in American chemistry, and few women were allowed in; Pauling, for example, used his influence to cut off the funding and block the publications of his rival, Dorothy Wrinch. Cathedrals of Science paints a colorful portrait of the building of modern chemistry from the late 19th to the mid-20th century.