Theoretical Chemistry and Physics of Heavy and Superheavy Elements

Theoretical Chemistry and Physics of Heavy and Superheavy Elements PDF Author: U. Kaldor
Publisher: Springer Science & Business Media
ISBN: 9401701059
Category : Science
Languages : en
Pages : 580

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Book Description
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.

Theoretical Chemistry and Physics of Heavy and Superheavy Elements

Theoretical Chemistry and Physics of Heavy and Superheavy Elements PDF Author: U. Kaldor
Publisher: Springer Science & Business Media
ISBN: 9401701059
Category : Science
Languages : en
Pages : 580

Get Book Here

Book Description
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.

The Chemistry of Superheavy Elements

The Chemistry of Superheavy Elements PDF Author: Matthias Schädel
Publisher: Springer Science & Business Media
ISBN: 1402012500
Category : Science
Languages : en
Pages : 324

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Book Description
This book is the first to treat the chemistry of superheavy elements, including important related nuclear aspects, as a self contained topic. It is written for those – students and novices -- who begin to work and those who are working in this fascinating and challenging field of the heaviest and superheavy elements, for their lecturers, their advisers and for the practicing scientists in the field – chemists and physicists - as the most complete source of reference about our today's knowledge of the chemistry of transactinides and superheavy elements. However, besides a number of very detailed discussions for the experts this book shall also provide interesting and easy to read material for teachers who are interested in this subject, for those chemists and physicists who are not experts in the field and for our interested fellow scientists in adjacent fields. Special emphasis is laid on an extensive coverage of the original literature in the reference part of each of the eight chapters to facilitate further and deeper studies of specific aspects. The index for each chapter should provide help to easily find a desired topic and to use this book as a convenient source to get fast access to a desired topic. Superheavy elements – chemical elements which are much heavier than those which we know of from our daily life – are a persistent dream in human minds and the kernel of science fiction literature for about a century.

Problems and Solutions in Quantum Chemistry and Physics

Problems and Solutions in Quantum Chemistry and Physics PDF Author: Charles S. Johnson
Publisher: Courier Corporation
ISBN: 0486151530
Category : Science
Languages : en
Pages : 750

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Book Description
Unusually varied problems, with detailed solutions, cover quantum mechanics, wave mechanics, angular momentum, molecular spectroscopy, scattering theory, more. 280 problems, plus 139 supplementary exercises.

Compendium of Theoretical Physics

Compendium of Theoretical Physics PDF Author: Armin Wachter
Publisher: Springer Science & Business Media
ISBN: 0387257993
Category : Science
Languages : en
Pages : 530

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Book Description
The Compendium of Theoretical Physics contains the canonical curriculum of theoretical physics. From classical mechanics over electrodynamics, quantum mechanics and statistical physics/thermodynamics, all topics are treated axiomatic-deductively and confimed by exercises, solutions and short summaries.

The Chemistry of Superheavy Elements

The Chemistry of Superheavy Elements PDF Author: Matthias Schädel
Publisher: Springer Science & Business Media
ISBN: 3642374662
Category : Science
Languages : en
Pages : 530

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Book Description
The second edition of "The Chemistry of the Superheavy Elements" provides a complete coverage of the chemistry of a series of elements beginning with atomic number 104 – the transactinides or superheavy elements – including their nuclear properties and production in nuclear reactions at heavy-ion accelerators. The contributors to this work include many renowned scientists who, during the last decades, have made vast contributions towards understanding the physics and chemistry of these elusive elements, both experimentally and theoretically. The main emphasis here is on demonstrating the fascinating studies involved in probing the architecture of the Periodic Table at its uppermost end, where relativistic effects drastically influence chemical properties. All known chemical properties of these elements are described together with the experimental techniques applied to study these short-lived man-made elements one atom-at-a-time. The status of theoretical chemistry and of empirical models is presented as well as aspects of nuclear physics. In addition, one chapter outlines the meanderings in this field from a historical perspective and the search for superheavy elements in Nature.

Relativistic Quantum Theory of Atoms and Molecules

Relativistic Quantum Theory of Atoms and Molecules PDF Author: Ian P Grant
Publisher: Springer Science & Business Media
ISBN: 0387350691
Category : Science
Languages : en
Pages : 813

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Book Description
This book is intended for physicists and chemists who need to understand the theory of atomic and molecular structure and processes, and who wish to apply the theory to practical problems. As far as practicable, the book provides a self-contained account of the theory of relativistic atomic and molecular structure, based on the accepted formalism of bound-state Quantum Electrodynamics. The author was elected a Fellow of the Royal Society of London in 1992.

Ionic Hydration in Chemistry and Biophysics

Ionic Hydration in Chemistry and Biophysics PDF Author: Brian E. Conway
Publisher:
ISBN: 9780444416995
Category :
Languages : en
Pages : 0

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Book Description


The Inorganic Radiochemistry of Heavy Elements

The Inorganic Radiochemistry of Heavy Elements PDF Author: Ivo Zvára
Publisher: Springer Science & Business Media
ISBN: 1402066023
Category : Science
Languages : en
Pages : 247

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Book Description
Written by one of the founders of gas-chromotagraphic methods in radiochemistry, this book attempts a genuine first. It is a discussion of the state of art of heavy element inorganic radiochemistry. It aims to be a real addition to the understanding of this crucial topic. Written as much for newcomers to the field as experts, its goal is also to stimulate wider use of the advantageous gas phase techniques for common elements.

The Fundamentals of Electron Density, Density Matrix and Density Functional Theory in Atoms, Molecules and the Solid State

The Fundamentals of Electron Density, Density Matrix and Density Functional Theory in Atoms, Molecules and the Solid State PDF Author: N.I. Gidopoulos
Publisher: Springer Science & Business Media
ISBN: 9781402017933
Category : Science
Languages : en
Pages : 256

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Book Description
This volume records the proceedings of a Forum on The Fundamentals of Electron Density, Density Matrix and Density Functional Theory in Atoms, Molecules and the Solid State held at the Coseners' House, Abingdon-on-Thames, Oxon. over the period 31st May - 2nd June, 2002. The forum consisted of 26 oral and poster presentations followed by a discussion structure around questions and comments submitted by the participants (and others who had expressed an interest) in advance of the meeting. Quantum mechanics provides a theoretical foundation for our under standing of the structure and properties of atoms, molecules and the solid state in terms their component particles, electrons and nuclei. (Rel ativistic quantum mechanics is required for molecular systems contain ing heavy atoms.) However, the solution of the equations of quantum mechanics yields a function, a wave function, which depends on the co ordinates, both space and spin, of all of the particles in the system. This functions contains much more information than is required to yield the energy or other property.

Relativistic Methods for Chemists

Relativistic Methods for Chemists PDF Author: Maria Barysz
Publisher: Springer Science & Business Media
ISBN: 1402099754
Category : Science
Languages : en
Pages : 622

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Book Description
“Relativistic Methods for Chemists”, written by a highly qualified team of authors, is targeted at both experimentalists and theoreticians interested in the area of relativistic effects in atomic and molecular systems and processes and in their consequences for the interpretation of the heavy element’s chemistry. The theoretical part of the book focuses on the relativistic methods for molecular calculations discussing relativistic two-component theory, density functional theory, pseudopotentials and correlations. The experimentally oriented chapters describe the use of relativistic methods in different applications focusing on the design of new materials based on heavy element compounds, the role of the spin-orbit coupling in photochemistry and photobiology, and chirality and its relations to relativistic description of matter and radiation. This book is written at an intermediate level in order to appeal to a broader audience than just experts working in the field of relativistic theory.