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Beyond Born-Oppenheimer [[electronic resource] ] : electronic non-adiabatic coupling terms and conical intersections / / by Michael Baer
| Beyond Born-Oppenheimer [[electronic resource] ] : electronic non-adiabatic coupling terms and conical intersections / / by Michael Baer |
| Autore | Baer M (Michael), <1937-> |
| Pubbl/distr/stampa | Hoboken, N.J., : Wiley, c2006 |
| Descrizione fisica | 1 online resource (254 p.) |
| Disciplina |
539.758
541/.28 |
| Soggetto topico |
Molecular dynamics - Mathematics
Born-Oppenheimer approximation Adiabatic invariants |
| Soggetto genere / forma | Electronic books |
| ISBN |
1-280-41143-0
9786610411436 0-470-32705-7 0-471-78008-1 0-471-78007-3 |
| Formato | Materiale a stampa  |
| Livello bibliografico | Monografia |
| Lingua di pubblicazione | eng |
| Nota di contenuto |
BEYOND BORN-OPPENHEIMER; CONTENTS; PREFACE; ABBREVIATIONS; 1 MATHEMATICAL INTRODUCTION; 1.1 Hilbert Space; 1.1.1 Eigenfunction and Electronic Nonadiabatic Coupling Term; 1.1.2 Abelian and Non-Abelian Curl Equations; 1.1.3 Abelian and Non-Abelian Divergence Equations; 1.2 Hilbert Subspace; 1.3 Vectorial First-Order Differential Equation and Line Integral; 1.3.1 Vectorial First-Order Differential Equation; 1.3.1.1 Study of Abelian Case; 1.3.1.2 Study of Non-Abelian Case; 1.3.1.3 Orthogonality; 1.3.2 Integral Equation; 1.3.2.1 Integral Equation along an Open Contour
1.3.2.2 Integral Equation along a Closed Contour1.3.3 Solution of Differential Vector Equation; 1.4 Summary and Conclusions; Problem; References; 2 BORN-OPPENHEIMER APPROACH: DIABATIZATION AND TOPOLOGICAL MATRIX; 2.1 Time-Independent Treatment; 2.1.1 Adiabatic Representation; 2.1.2 Diabatic Representation; 2.1.3 Adiabatic-to-Diabatic Transformation; 2.1.3.1 Transformation for Electronic Basis Sets; 2.1.3.2 Transformation for Nuclear Wavefunctions; 2.1.3.3 Implications Due to Adiabatic-to-Diabatic Transformation; 2.1.3.4 Final Comments; 2.2 Application of Complex Eigenfunctions 2.2.1 Introducing Time-Independent Phase Factors2.2.1.1 Adiabatic Schrödinger Equation; 2.2.1.2 Adiabatic-to-Diabatic Transformation; 2.2.2 Introducing Time-Dependent Phase Factors; 2.3 Time-Dependent Treatment; 2.3.1 Time-Dependent Perturbative Approach; 2.3.2 Time-Dependent Nonperturbative Approach; 2.3.2.1 Adiabatic Time-Dependent Electronic Basis Set; 2.3.2.2 Adiabatic Time-Dependent Nuclear Schrödinger Equation; 2.3.2.3 Time-Dependent Adiabatic-to-Diabatic Transformation; 2.3.3 Summary; Problem; 2A Appendixes; 2A.1 Dressed Nonadiabatic Coupling Matrix 2A.2 Analyticity of Adiabatic-to-Diabatic Transformation Matrix à in Spacetime ConfigurationReferences; 3 MODEL STUDIES; 3.1 Treatment of Analytical Models; 3.1.1 Two-State Systems; 3.1.1.1 Adiabatic-to-Diabatic Transformation Matrix; 3.1.1.2 Topological (D) Matrix; 3.1.1.3 The Diabatic Potential Matrix; 3.1.2 Three-State Systems; 3.1.2.1 Adiabatic-to-Diabatic Transformation Matrix; 3.1.2.2 Topological Matrix; 3.1.3 Four-State Systems; 3.1.3.1 Adiabatic-to-Diabatic Transformation Matrix; 3.1.3.2 Topological Matrix; 3.1.4 Comments Related to General Case 4.3 Quantization of Nonadiabatic Coupling Matrix: Study of Ab Initio Molecular Systems |
| Record Nr. | UNINA-9910143416003321 |
Baer M (Michael), <1937->
|
||
| Hoboken, N.J., : Wiley, c2006 | ||
| Materiale a stampa | ||
| Lo trovi qui: Univ. Federico II | ||
| ||
Beyond Born-Oppenheimer [[electronic resource] ] : electronic non-adiabatic coupling terms and conical intersections / / by Michael Baer
| Beyond Born-Oppenheimer [[electronic resource] ] : electronic non-adiabatic coupling terms and conical intersections / / by Michael Baer |
| Autore | Baer M (Michael), <1937-> |
| Pubbl/distr/stampa | Hoboken, N.J., : Wiley, c2006 |
| Descrizione fisica | 1 online resource (254 p.) |
| Disciplina |
539.758
541/.28 |
| Soggetto topico |
Molecular dynamics - Mathematics
Born-Oppenheimer approximation Adiabatic invariants |
| ISBN |
1-280-41143-0
9786610411436 0-470-32705-7 0-471-78008-1 0-471-78007-3 |
| Formato | Materiale a stampa |
| Livello bibliografico | Monografia |
| Lingua di pubblicazione | eng |
| Nota di contenuto |
BEYOND BORN-OPPENHEIMER; CONTENTS; PREFACE; ABBREVIATIONS; 1 MATHEMATICAL INTRODUCTION; 1.1 Hilbert Space; 1.1.1 Eigenfunction and Electronic Nonadiabatic Coupling Term; 1.1.2 Abelian and Non-Abelian Curl Equations; 1.1.3 Abelian and Non-Abelian Divergence Equations; 1.2 Hilbert Subspace; 1.3 Vectorial First-Order Differential Equation and Line Integral; 1.3.1 Vectorial First-Order Differential Equation; 1.3.1.1 Study of Abelian Case; 1.3.1.2 Study of Non-Abelian Case; 1.3.1.3 Orthogonality; 1.3.2 Integral Equation; 1.3.2.1 Integral Equation along an Open Contour
1.3.2.2 Integral Equation along a Closed Contour1.3.3 Solution of Differential Vector Equation; 1.4 Summary and Conclusions; Problem; References; 2 BORN-OPPENHEIMER APPROACH: DIABATIZATION AND TOPOLOGICAL MATRIX; 2.1 Time-Independent Treatment; 2.1.1 Adiabatic Representation; 2.1.2 Diabatic Representation; 2.1.3 Adiabatic-to-Diabatic Transformation; 2.1.3.1 Transformation for Electronic Basis Sets; 2.1.3.2 Transformation for Nuclear Wavefunctions; 2.1.3.3 Implications Due to Adiabatic-to-Diabatic Transformation; 2.1.3.4 Final Comments; 2.2 Application of Complex Eigenfunctions 2.2.1 Introducing Time-Independent Phase Factors2.2.1.1 Adiabatic Schrödinger Equation; 2.2.1.2 Adiabatic-to-Diabatic Transformation; 2.2.2 Introducing Time-Dependent Phase Factors; 2.3 Time-Dependent Treatment; 2.3.1 Time-Dependent Perturbative Approach; 2.3.2 Time-Dependent Nonperturbative Approach; 2.3.2.1 Adiabatic Time-Dependent Electronic Basis Set; 2.3.2.2 Adiabatic Time-Dependent Nuclear Schrödinger Equation; 2.3.2.3 Time-Dependent Adiabatic-to-Diabatic Transformation; 2.3.3 Summary; Problem; 2A Appendixes; 2A.1 Dressed Nonadiabatic Coupling Matrix 2A.2 Analyticity of Adiabatic-to-Diabatic Transformation Matrix à in Spacetime ConfigurationReferences; 3 MODEL STUDIES; 3.1 Treatment of Analytical Models; 3.1.1 Two-State Systems; 3.1.1.1 Adiabatic-to-Diabatic Transformation Matrix; 3.1.1.2 Topological (D) Matrix; 3.1.1.3 The Diabatic Potential Matrix; 3.1.2 Three-State Systems; 3.1.2.1 Adiabatic-to-Diabatic Transformation Matrix; 3.1.2.2 Topological Matrix; 3.1.3 Four-State Systems; 3.1.3.1 Adiabatic-to-Diabatic Transformation Matrix; 3.1.3.2 Topological Matrix; 3.1.4 Comments Related to General Case 4.3 Quantization of Nonadiabatic Coupling Matrix: Study of Ab Initio Molecular Systems |
| Record Nr. | UNINA-9910830642703321 |
|
Baer M (Michael), <1937->
|
||
| Hoboken, N.J., : Wiley, c2006 | ||
| Materiale a stampa | ||
| Lo trovi qui: Univ. Federico II | ||
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Elastic and inelastic scattering in electron diffraction and imaging / Zhong Lin Wang
| Elastic and inelastic scattering in electron diffraction and imaging / Zhong Lin Wang |
| Autore | Wang, Zhong Lin |
| Pubbl/distr/stampa | New York, : Plenum Press, c1995 |
| Descrizione fisica | XXVII, 448 p. ; 24 cm. |
| Disciplina | 539.758 |
| Soggetto topico |
Microscopio elettronico
Scattering |
| ISBN | 0306449293 |
| Formato | Materiale a stampa |
| Livello bibliografico | Monografia |
| Lingua di pubblicazione | eng |
| Record Nr. | UNICAS-RML0302807 |
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Wang, Zhong Lin
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| New York, : Plenum Press, c1995 | ||
| Materiale a stampa | ||
| Lo trovi qui: Univ. di Cassino e del Lazio Meridionale | ||
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Electromagnetic and acoustic scattering : detection and inverse problem : 21May - 3 June 1988, Marseille-Luminy, France / editors C. Bourrely ... [et al.]
| Electromagnetic and acoustic scattering : detection and inverse problem : 21May - 3 June 1988, Marseille-Luminy, France / editors C. Bourrely ... [et al.] |
| Pubbl/distr/stampa | Singapore : World Scientific, copyr. 1989 |
| Disciplina | 539.758 |
| Soggetto non controllato | diffusione fisica nucleare congressi 198 |
| ISBN | 9971-50-748-X |
| Formato | Materiale a stampa |
| Livello bibliografico | Monografia |
| Lingua di pubblicazione | eng |
| Record Nr. | UNISA-990000147890203316 |
| Singapore : World Scientific, copyr. 1989 | ||
| Materiale a stampa | ||
| Lo trovi qui: Univ. di Salerno | ||
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Electromagnetic response functions of nuclei / Rinaldo Cenni (ed.)
| Electromagnetic response functions of nuclei / Rinaldo Cenni (ed.) |
| Autore | Cenni, Rinaldo |
| Pubbl/distr/stampa | Huntington, N.Y. : Nova Science, c2001 |
| Descrizione fisica | 318 p. : ill. ; 27 cm |
| Disciplina | 539.758 |
| Soggetto topico | Electron-nucleus scattering |
| ISBN | 1560729422 |
| Classificazione |
53.4.16
LC QC793.5 |
| Formato | Materiale a stampa |
| Livello bibliografico | Monografia |
| Lingua di pubblicazione | eng |
| Record Nr. | UNISALENTO-991003071759707536 |
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Cenni, Rinaldo
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| Huntington, N.Y. : Nova Science, c2001 | ||
| Materiale a stampa | ||
| Lo trovi qui: Univ. del Salento | ||
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Fano Resonances in Optics and Microwaves : Physics and Applications / / edited by Eugene Kamenetskii, Almas Sadreev, Andrey Miroshnichenko
| Fano Resonances in Optics and Microwaves : Physics and Applications / / edited by Eugene Kamenetskii, Almas Sadreev, Andrey Miroshnichenko |
| Edizione | [1st ed. 2018.] |
| Pubbl/distr/stampa | Cham : , : Springer International Publishing : , : Imprint : Springer, , 2018 |
| Descrizione fisica | 1 online resource (XXIII, 582 p. 259 illus., 206 illus. in color.) |
| Disciplina | 539.758 |
| Collana | Springer Series in Optical Sciences |
| Soggetto topico |
Atomic structure
Molecular structure Microwaves Optical engineering Spectrum analysis Microscopy Semiconductors Physical measurements Measurement Optics Electrodynamics Atomic/Molecular Structure and Spectra Microwaves, RF and Optical Engineering Spectroscopy and Microscopy Measurement Science and Instrumentation Classical Electrodynamics |
| ISBN | 3-319-99731-9 |
| Formato | Materiale a stampa |
| Livello bibliografico | Monografia |
| Lingua di pubblicazione | eng |
| Nota di contenuto | Theory of Fano Resonances -- Bound States in a Continuum -- Fano Resonances and Field-Matter Chirality -- Fano Resonances in Plasmonic Structures and Metamaterials -- Fano Resonances in Microwave Structures -- Fano Resonances for Biosensing. |
| Record Nr. | UNINA-9910300545903321 |
| Cham : , : Springer International Publishing : , : Imprint : Springer, , 2018 | ||
| Materiale a stampa | ||
| Lo trovi qui: Univ. Federico II | ||
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Finite elements and finite difference methods in electromagnetic scattering / editor Michael A. Morgan
| Finite elements and finite difference methods in electromagnetic scattering / editor Michael A. Morgan |
| Pubbl/distr/stampa | New York : Elsevier, copyr. 1990 |
| Disciplina | 539.758 |
| Soggetto non controllato | diffusione fisica nucleare modelli matem |
| ISBN | 0-444-01518-3 |
| Formato | Materiale a stampa |
| Livello bibliografico | Monografia |
| Lingua di pubblicazione | eng |
| Record Nr. | UNISA-990000150950203316 |
| New York : Elsevier, copyr. 1990 | ||
| Materiale a stampa | ||
| Lo trovi qui: Univ. di Salerno | ||
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Handbook of spallation research : theory, experiments and applications
| Handbook of spallation research : theory, experiments and applications |
| Autore | Filges D |
| Pubbl/distr/stampa | [Place of publication not identified], : Wiley VCH, 2009 |
| Disciplina | 539.758 |
| Soggetto topico |
Spallation (Nuclear physics)
Physics Physical Sciences & Mathematics Nuclear Physics |
| ISBN | 3-527-62886-X |
| Formato | Materiale a stampa |
| Livello bibliografico | Monografia |
| Lingua di pubblicazione | eng |
| Record Nr. | UNINA-9910139410303321 |
|
Filges D
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||
| [Place of publication not identified], : Wiley VCH, 2009 | ||
| Materiale a stampa | ||
| Lo trovi qui: Univ. Federico II | ||
| ||
Handbook of spallation research : theory, experiments and applications
| Handbook of spallation research : theory, experiments and applications |
| Autore | Filges D |
| Pubbl/distr/stampa | [Place of publication not identified], : Wiley VCH, 2009 |
| Disciplina | 539.758 |
| Soggetto topico |
Spallation (Nuclear physics)
Physics Physical Sciences & Mathematics Nuclear Physics |
| ISBN | 3-527-62886-X |
| Formato | Materiale a stampa |
| Livello bibliografico | Monografia |
| Lingua di pubblicazione | eng |
| Record Nr. | UNINA-9910830931303321 |
|
Filges D
|
||
| [Place of publication not identified], : Wiley VCH, 2009 | ||
| Materiale a stampa | ||
| Lo trovi qui: Univ. Federico II | ||
| ||
Handbook of spallation research : theory, experiments and applications
| Handbook of spallation research : theory, experiments and applications |
| Autore | Filges D |
| Pubbl/distr/stampa | [Place of publication not identified], : Wiley VCH, 2009 |
| Disciplina | 539.758 |
| Soggetto topico |
Spallation (Nuclear physics)
Physics Physical Sciences & Mathematics Nuclear Physics |
| ISBN | 3-527-62886-X |
| Formato | Materiale a stampa |
| Livello bibliografico | Monografia |
| Lingua di pubblicazione | eng |
| Record Nr. | UNINA-9911020132503321 |
|
Filges D
|
||
| [Place of publication not identified], : Wiley VCH, 2009 | ||
| Materiale a stampa | ||
| Lo trovi qui: Univ. Federico II | ||
| ||