Author: John Clarke Slater
Publisher: McGraw-Hill Companies
ISBN:
Category : Science
Languages : en
Pages : 616
Book Description
V. 1. Electronic structure of molecules.--v. 2. Symmetry and energy bands in crystals.--v. 3. Insulators, semiconductors, and metals.--v. 4. The self-consistent field for molecules and solids.
Quantum Theory of Molecules and Solids: The self-consistent field for molecules and solids
Author: John Clarke Slater
Publisher: McGraw-Hill Companies
ISBN:
Category : Science
Languages : en
Pages : 616
Book Description
V. 1. Electronic structure of molecules.--v. 2. Symmetry and energy bands in crystals.--v. 3. Insulators, semiconductors, and metals.--v. 4. The self-consistent field for molecules and solids.
Publisher: McGraw-Hill Companies
ISBN:
Category : Science
Languages : en
Pages : 616
Book Description
V. 1. Electronic structure of molecules.--v. 2. Symmetry and energy bands in crystals.--v. 3. Insulators, semiconductors, and metals.--v. 4. The self-consistent field for molecules and solids.
Quantum Theory of Molecules and Solids. Vol. 4
The Self-consistent Field for Molecules and Solids
Author: John Clarke Slater
Publisher:
ISBN:
Category : Molecules
Languages : en
Pages : 583
Book Description
Publisher:
ISBN:
Category : Molecules
Languages : en
Pages : 583
Book Description
Quantum Theory of Molecules and Solids: The self-consistent field for molecules and solids
Author: John Clarke Slater
Publisher: McGraw-Hill Companies
ISBN:
Category : Science
Languages : en
Pages : 616
Book Description
V. 1. Electronic structure of molecules.--v. 2. Symmetry and energy bands in crystals.--v. 3. Insulators, semiconductors, and metals.--v. 4. The self-consistent field for molecules and solids.
Publisher: McGraw-Hill Companies
ISBN:
Category : Science
Languages : en
Pages : 616
Book Description
V. 1. Electronic structure of molecules.--v. 2. Symmetry and energy bands in crystals.--v. 3. Insulators, semiconductors, and metals.--v. 4. The self-consistent field for molecules and solids.
Quantum Theory of Molecules and Solids: Electronic structure of molecules
Author: John Clarke Slater
Publisher:
ISBN:
Category : Molecules
Languages : en
Pages : 514
Book Description
Publisher:
ISBN:
Category : Molecules
Languages : en
Pages : 514
Book Description
Quantum Theory of Atoms, Molecules, and the Solid State
Author: John Clarke Slater
Publisher:
ISBN:
Category : Science
Languages : en
Pages : 672
Book Description
Publisher:
ISBN:
Category : Science
Languages : en
Pages : 672
Book Description
Local Density Approximations in Quantum Chemistry and Solid State Physics
Author: Jens Peder Dahl
Publisher: Springer Science & Business Media
ISBN: 1489921427
Category : Science
Languages : en
Pages : 848
Book Description
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.
Publisher: Springer Science & Business Media
ISBN: 1489921427
Category : Science
Languages : en
Pages : 848
Book Description
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.
Density Functional Theory of Molecules, Clusters, and Solids
Author: D.E. Ellis
Publisher: Springer Science & Business Media
ISBN: 9401104875
Category : Science
Languages : en
Pages : 321
Book Description
Rapid advances are taking place in the application of density functional theory (DFT) to describe complex electronic structures, to accurately treat large systems and to predict physical and chemical properties. Both theoretical content and computational methodology are developing at a pace which offers researchers new opportunities in areas such as quantum chemistry, cluster science, and solid state physics. This volume contains ten contributions by leading scientists in the field and provides an authoritative overview of the most important developments. The book focuses on the following themes: determining adequate approximations for the many-body problem of electronic correlations; how to transform these approximations into computational algorithms; applications to discover and predict properties of electronic systems; and developing the theory. For researchers in surface chemistry, catalysis, ceramics and inorganic chemistry.
Publisher: Springer Science & Business Media
ISBN: 9401104875
Category : Science
Languages : en
Pages : 321
Book Description
Rapid advances are taking place in the application of density functional theory (DFT) to describe complex electronic structures, to accurately treat large systems and to predict physical and chemical properties. Both theoretical content and computational methodology are developing at a pace which offers researchers new opportunities in areas such as quantum chemistry, cluster science, and solid state physics. This volume contains ten contributions by leading scientists in the field and provides an authoritative overview of the most important developments. The book focuses on the following themes: determining adequate approximations for the many-body problem of electronic correlations; how to transform these approximations into computational algorithms; applications to discover and predict properties of electronic systems; and developing the theory. For researchers in surface chemistry, catalysis, ceramics and inorganic chemistry.
The Quantum Theory of Atoms in Molecules
Author: Chérif F. Matta
Publisher: John Wiley & Sons
ISBN: 3527307486
Category : Science
Languages : en
Pages : 567
Book Description
This book distills the knowledge gained from research into atoms in molecules over the last 10 years into a unique, handy reference. Throughout, the authors address a wide audience, such that this volume may equally be used as a textbook without compromising its research-oriented character. Clearly structured, the text begins with advances in theory before moving on to theoretical studies of chemical bonding and reactivity. There follow separate sections on solid state and surfaces as well as experimental electron densities, before finishing with applications in biological sciences and drug-design. The result is a must-have for physicochemists, chemists, physicists, spectroscopists and materials scientists.
Publisher: John Wiley & Sons
ISBN: 3527307486
Category : Science
Languages : en
Pages : 567
Book Description
This book distills the knowledge gained from research into atoms in molecules over the last 10 years into a unique, handy reference. Throughout, the authors address a wide audience, such that this volume may equally be used as a textbook without compromising its research-oriented character. Clearly structured, the text begins with advances in theory before moving on to theoretical studies of chemical bonding and reactivity. There follow separate sections on solid state and surfaces as well as experimental electron densities, before finishing with applications in biological sciences and drug-design. The result is a must-have for physicochemists, chemists, physicists, spectroscopists and materials scientists.
Quantum Theory of Molecules and Solids: Insulators, semiconductors, and metals
Author: John Clarke Slater
Publisher:
ISBN:
Category : Matter
Languages : en
Pages : 584
Book Description
Publisher:
ISBN:
Category : Matter
Languages : en
Pages : 584
Book Description