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Ab initio methods in quantum chemistry . II [[electronic resource] /] / edited by K.P Lawley
Ab initio methods in quantum chemistry . II [[electronic resource] /] / edited by K.P Lawley
Pubbl/distr/stampa Chichester [West Sussex] ; ; New York, : Wiley, c1987
Descrizione fisica 1 online resource (600 p.)
Disciplina 541.2/8
541.28
541.305
541/.08
Altri autori (Persone) LawleyK. P
Collana Advances in chemical physics
Soggetto topico Quantum chemistry
Quantum theory
Soggetto genere / forma Electronic books.
ISBN 1-282-34723-3
9786612347238
0-470-14294-4
0-470-14338-X
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto AB INITIO METHODS IN QUANTUM CHEMISTRY -II; CONTENTS; MATRIX-FORMULATED DIRECT MULTICONFIGURATION SELF-CONSISTENT FIELD AND MULTICONFIGURATION REFERENCE CONFIGURATION-INTERACTION; THE MULTICONFIGURATION SELF-CONSISTENT FIELD METHOD; PROPAGATOR METHODS; ANALYTICAL DERIVATIVE METHODS IN QUANTUM CHEMISTRY; SYMMETRY AND DEGENERACY IN Xa AND DENSITY FUNCTIONAL THEORY; MODERN VALENCE BOND THEORY; THE COMPLETE ACTIVE SPACE SELF-CONSISTENT FIELD METHOD AND ITS APPLICATIONS IN ELECTRONIC STRUCTURE CALCULATIONS; TRANSITION-METAL ATOMS AND DIMERS; WEAKLY BONDED SYSTEMS; AUTHOR INDEX; COMPOUND INDEX
SUBJECT INDEX
Record Nr. UNINA-9910144254203321
Chichester [West Sussex] ; ; New York, : Wiley, c1987
Materiale a stampa
Lo trovi qui: Univ. Federico II
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Ab initio methods in quantum chemistry . Part I [[electronic resource] /] / edited by K.P Lawley
Ab initio methods in quantum chemistry . Part I [[electronic resource] /] / edited by K.P Lawley
Pubbl/distr/stampa Chichester [West Sussex] ; ; New York, : Wiley, c1987
Descrizione fisica 1 online resource (568 p.)
Disciplina 541.2/8
541.28
541.305
541/.08
Altri autori (Persone) LawleyK. P
Collana Advances in chemical physics
Soggetto topico Quantum chemistry
Quantum theory
Soggetto genere / forma Electronic books.
ISBN 1-282-34722-5
9786612347221
0-470-14293-6
0-470-14337-1
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto AB INITIO METHODS IN QUANTUM CHEMISTRY-Part I; CONTENTS; EXCITED-STATE POTENTIALS; MOLECULAR PROPERTY DERIVATIVES; TRANSITION STRUCTURE COMPUTATIONS AND THEIR ANALYSIS; OPTIMIZATION OF EQUILIBRIUM GEOMETRIES AND TRANSITION STRUCTURES; RELATIVISTIC QUANTUM CHEMISTRY; EFFECTIVE HAMILTONIANS AND PSEUDO-OPERATORS AS TOOLS FOR RIGOROUS MODELLING; MOLECULAR CALCULATIONS WITH THE DENSITY FUNCTIONAL FORMALISM; BASIS SETS; THE COUPLED PAIR .APPROXIMATION; AUTHOR INDEX; SUBJECT INDEX
Record Nr. UNINA-9910144254503321
Chichester [West Sussex] ; ; New York, : Wiley, c1987
Materiale a stampa
Lo trovi qui: Univ. Federico II
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Absolutely small [[electronic resource] ] : how quantum theory explains our everyday world / / Michael D. Fayer
Absolutely small [[electronic resource] ] : how quantum theory explains our everyday world / / Michael D. Fayer
Autore Fayer Michael D
Pubbl/distr/stampa New York, : AMACOM, c2010
Descrizione fisica 1 online resource (396 p.)
Disciplina 530.12
Soggetto topico Quantum theory
Quantum chemistry
ISBN 1-282-65778-X
9786612657788
0-8144-1491-5
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Schrödinger's cat -- Size is absolute -- Some things about waves -- The photoelectric effect and Einstein's explanation -- Light: waves or particles? -- How big is a photon and the Heisenberg uncertainty principle -- Photons, electrons, and baseballs -- Quantum racquetball and the color of fruit -- The hydrogen atom: the history -- The hydrogen atom: quantum theory -- Many electron atoms and the periodic table of elements -- The hydrogen molecule and the covalent bond -- What holds atoms together - diatomic molecules -- Bigger molecules: the shapes of polyatomic molecules -- Beer and soap -- Fat, it's all about the double bonds -- Green house gases -- Aromatic molecules -- Metals, insulators, and semiconductors -- Think quantum.
Record Nr. UNINA-9910785067603321
Fayer Michael D  
New York, : AMACOM, c2010
Materiale a stampa
Lo trovi qui: Univ. Federico II
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Accurate condensed-phase quantum chemistry / / editor, Frederick R. Manby
Accurate condensed-phase quantum chemistry / / editor, Frederick R. Manby
Pubbl/distr/stampa Boca Raton : , : Taylor & Francis, , 2011
Descrizione fisica 1 online resource (214 p.)
Disciplina 541/.28
Altri autori (Persone) ManbyFrederick R
Collana Computation in chemistry
Soggetto topico Quantum chemistry
Condensed matter
Soggetto genere / forma Electronic books.
ISBN 0-429-13424-X
1-4398-0837-6
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Front cover; Contents; Series Preface; Preface; Editor; Contributors; chapter one. Laplace transform second-order Møller-Plesset methods in the atomic orbital basis for periodic systems; chapter two. Density fitting for correlated calculations in periodic systems; chapter three. The method of increments-a wavefunction-based correlation method for extended systems; chapter four. The hierarchical scheme for electron correlation in crystalline solids; chapter five. Electrostatically embedded many-body expansion for large systems
chapter six. Electron correlation in solids: Delocalized and localized orbital approacheschapter seven. Ab initio Monte Carlo simulations of liquid water; Back cover
Record Nr. UNINA-9910460024603321
Boca Raton : , : Taylor & Francis, , 2011
Materiale a stampa
Lo trovi qui: Univ. Federico II
Opac: Controlla la disponibilità qui
Accurate condensed-phase quantum chemistry / / editor, Frederick R. Manby
Accurate condensed-phase quantum chemistry / / editor, Frederick R. Manby
Pubbl/distr/stampa Boca Raton : , : Taylor & Francis, , 2011
Descrizione fisica 1 online resource (214 p.)
Disciplina 541/.28
Altri autori (Persone) ManbyFrederick R
Collana Computation in chemistry
Soggetto topico Quantum chemistry
Condensed matter
ISBN 0-429-13424-X
1-4398-0837-6
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Front cover; Contents; Series Preface; Preface; Editor; Contributors; chapter one. Laplace transform second-order Møller-Plesset methods in the atomic orbital basis for periodic systems; chapter two. Density fitting for correlated calculations in periodic systems; chapter three. The method of increments-a wavefunction-based correlation method for extended systems; chapter four. The hierarchical scheme for electron correlation in crystalline solids; chapter five. Electrostatically embedded many-body expansion for large systems
chapter six. Electron correlation in solids: Delocalized and localized orbital approacheschapter seven. Ab initio Monte Carlo simulations of liquid water; Back cover
Record Nr. UNINA-9910785152103321
Boca Raton : , : Taylor & Francis, , 2011
Materiale a stampa
Lo trovi qui: Univ. Federico II
Opac: Controlla la disponibilità qui
Accurate condensed-phase quantum chemistry / / editor, Frederick R. Manby
Accurate condensed-phase quantum chemistry / / editor, Frederick R. Manby
Pubbl/distr/stampa Boca Raton : , : Taylor & Francis, , 2011
Descrizione fisica 1 online resource (214 p.)
Disciplina 541/.28
Altri autori (Persone) ManbyFrederick R
Collana Computation in chemistry
Soggetto topico Quantum chemistry
Condensed matter
ISBN 0-429-13424-X
1-4398-0837-6
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Front cover; Contents; Series Preface; Preface; Editor; Contributors; chapter one. Laplace transform second-order Møller-Plesset methods in the atomic orbital basis for periodic systems; chapter two. Density fitting for correlated calculations in periodic systems; chapter three. The method of increments-a wavefunction-based correlation method for extended systems; chapter four. The hierarchical scheme for electron correlation in crystalline solids; chapter five. Electrostatically embedded many-body expansion for large systems
chapter six. Electron correlation in solids: Delocalized and localized orbital approacheschapter seven. Ab initio Monte Carlo simulations of liquid water; Back cover
Record Nr. UNINA-9910799969803321
Boca Raton : , : Taylor & Francis, , 2011
Materiale a stampa
Lo trovi qui: Univ. Federico II
Opac: Controlla la disponibilità qui
Advanced quantum technologies
Advanced quantum technologies
Pubbl/distr/stampa Berlin, Germany : , : Wiley-VCH Verlag GmbH & Co. KGaA, , [2018]-
Descrizione fisica 1 online resource
Disciplina 537.5
Soggetto topico Quantum theory
Quantum computing
Quantum chemistry
Soggetto genere / forma Periodicals.
ISSN 2511-9044
Formato Materiale a stampa
Livello bibliografico Periodico
Lingua di pubblicazione eng
Altri titoli varianti Adv. Quantum Technol
QUTE
Record Nr. UNINA-9910329440603321
Berlin, Germany : , : Wiley-VCH Verlag GmbH & Co. KGaA, , [2018]-
Materiale a stampa
Lo trovi qui: Univ. Federico II
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Advanced quantum technologies
Advanced quantum technologies
Pubbl/distr/stampa Berlin, Germany : , : Wiley-VCH Verlag GmbH & Co. KGaA, , [2018]-
Descrizione fisica 1 online resource
Disciplina 537.5
Soggetto topico Quantum theory
Quantum computing
Quantum chemistry
Soggetto genere / forma Periodicals.
ISSN 2511-9044
Formato Materiale a stampa
Livello bibliografico Periodico
Lingua di pubblicazione eng
Altri titoli varianti Adv. Quantum Technol
QUTE
Record Nr. UNISA-996326243303316
Berlin, Germany : , : Wiley-VCH Verlag GmbH & Co. KGaA, , [2018]-
Materiale a stampa
Lo trovi qui: Univ. di Salerno
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Advances in quantum methods and applications in chemistry, physics, and biology / / Matti Hotokka [and three others], editors
Advances in quantum methods and applications in chemistry, physics, and biology / / Matti Hotokka [and three others], editors
Edizione [1st ed. 2013.]
Pubbl/distr/stampa Cham [Switzerland] : , : Springer, , 2013
Descrizione fisica 1 online resource (xv, 379 pages) : illustrations (some color)
Disciplina 530.1
530.41
Collana Progress in Theoretical Chemistry and Physics
Soggetto topico Quantum chemistry
Quantum theory
ISBN 3-319-01529-X
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Concepts and Methods in Quantum Chemistry.-Relativistic Effects in Quantum Chemistry.-Molecular Structure, Dynamics, and Spectroscopy -- Atoms and Molecules in Strong Electric and Magnetic Fields.-Reactive Collisions and Chemical Reactions -- Condensed Matter; Complexes and Clusters; Surfaces and Interfaces.-Molecular and Nano-Materials, Electronics and Biology.-Computational Chemistry, Physics and Biology.-Catalysis.
Record Nr. UNINA-9910437807703321
Cham [Switzerland] : , : Springer, , 2013
Materiale a stampa
Lo trovi qui: Univ. Federico II
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Algebraic and diagrammatic methods in many-fermion theory / Frank E. Harris, Hendrik J. Monkhorst, David L. Freeman
Algebraic and diagrammatic methods in many-fermion theory / Frank E. Harris, Hendrik J. Monkhorst, David L. Freeman
Autore Harris, Frank E.
Pubbl/distr/stampa New York : Oxford University Press, 1992
Descrizione fisica vii, 403 p. : ill. ; 24 cm
Disciplina 541.2
Altri autori (Persone) Monkhorst, Hendrik Janauthor
Freeman, David L.
Soggetto topico Fermions - Mathematics
Many-body problem
Nuclear models - Mathematics
Feynman diagrams
Quantum chemistry
ISBN 9780195061307
Classificazione LC QD455.3.M3
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Record Nr. UNISALENTO-991003806619707536
Harris, Frank E.  
New York : Oxford University Press, 1992
Materiale a stampa
Lo trovi qui: Univ. del Salento
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