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The Resource Advances in the Theory of Quantum Systems in Chemistry and Physics, edited by Philip E. Hoggan, Erkki J. Brändas, Jean Maruani, Piotr Piecuch, Gerardo DelgadoBarrio, (electronic resource)
Advances in the Theory of Quantum Systems in Chemistry and Physics, edited by Philip E. Hoggan, Erkki J. Brändas, Jean Maruani, Piotr Piecuch, Gerardo DelgadoBarrio, (electronic resource)
Resource Information
The item Advances in the Theory of Quantum Systems in Chemistry and Physics, edited by Philip E. Hoggan, Erkki J. Brändas, Jean Maruani, Piotr Piecuch, Gerardo DelgadoBarrio, (electronic resource) represents a specific, individual, material embodiment of a distinct intellectual or artistic creation found in University of Oklahoma Libraries.This item is available to borrow from all library branches.
Resource Information
The item Advances in the Theory of Quantum Systems in Chemistry and Physics, edited by Philip E. Hoggan, Erkki J. Brändas, Jean Maruani, Piotr Piecuch, Gerardo DelgadoBarrio, (electronic resource) represents a specific, individual, material embodiment of a distinct intellectual or artistic creation found in University of Oklahoma Libraries.
This item is available to borrow from all library branches.
 Summary
 Advances in the Theory of Quantum Systems in Chemistry and Physics is a collection of 32 selected papers from the scientific contributions presented at the 15th International Workshop on Quantum Systems in Chemistry and Physics (QSCPXV), held at Magdalene College, Cambridge, UK, from August 31st to September 5th, 2010. This volume discusses the state of the art, new trends, and the future of methods in molecular quantum mechanics and their applications to a wide range of problems in chemistry, physics, and biology. The breadth and depth of the scientific topics discussed during QSCPXV are gathered in seven sections: I. Fundamental Theory; II. Model Atoms; III. Atoms and Molecules with ExponentialType Orbitals; IV. DensityOriented Methods; V. Dynamics and Quantum MonteCarlo Methodology; VI. Structure and Reactivity; VII. Complex Systems, Solids, Biophysics. Advances in the Theory of Quantum Systems in Chemistry and Physics is written for research students and professionals in Quantum systems of chemistry and physics. It also constitutes and invaluable guide for those wishing to familiarise themselves with research perspectives in the domain of quantum systems for thematic conversion or simply to gain insight into the methodological developments and applications to physics chemistry and biology that have actually become feasible by the end of 2010
 Language

 eng
 eng
 Edition
 1st ed. 2012.
 Extent
 1 online resource (629 p.)
 Note
 Description based upon print version of record
 Contents

 Time Asymmetry and the Evolution of Physical Laws
 SpatiallyDependentMass Schrödinger Equations with Morse Oscillator Eigenvalues: Isospectral Potentials and Factorization Operators
 Relativistic Theory of Cooperative MuonNuclear Processes: Negative Muon Capture and Metastable Nucleus Discharge
 TwoRange Addition Theorem for Coulomb Sturmians
 Why Specific ETOs are Advantageous for NMR and Molecular Interactions
 Progress in HylleraasCI Calculations on Boron
 Structural and Electronic Properties of Polonium under Hydrostatic Pressure
 Complexity Analysis of the Hydrogenic Spectrum in Strong Fields
 Atomic Density Functions: Atomic Physics Calculations Analyzed with Methods from Quantum Chemistry
 Understanding Maximum Probability Domains with Simple Models
 Density Scaling for Excited States
 Finite Element Method in DFT Electronic Structure Calculations
 Shifts in Excitation Energies Induced by Hydrogen Bonding: A Comparison of the Embedding and Supermolecular TimeDependent DFT Calculations with the EquationofMotion CoupledCluster Results
 Multiparticle Distribution of Fermi Gas System in Any Dimension
 Hierarchical EffectiveMode Approach for Extended Molecular Systems
 ShortTime Dynamics through Conical Intersections in Macrosystems: Quadratic Coupling Extension
 Theoretical Methods for Nonadiabatic Dynamics “on the fly” in Complex Systems and its Control by Laser Fields
 A Survey on Reptation Quantum Monte Carlo
 Quantum Monte Carlo Calculations of Electronic Excitation Energies: the Case of the Singlet n → (CO) Transition in Acrolein
 Analysis of the ChargeTransfer Mechanism in IonMolecule Collisions
 Recombination by Electron Capture in the Interstellar Medium
 Systematic Exploration of Chemical Structures and Reaction Pathways on the Quantum Chemical Potential Energy Surface by Means of the Anharmonic Downward DistortionFollowing Method
 Neutral Hydrolysis of Methyl Formate from Abinitio Potentials and Molecular Dynamics Simulation
 Radial Coupling and Adiabatic Correction for the LiRb Molecule
 CentreofMass Separation in Quantum Mechanics: Implications for the ManyBody Treatment in Quantum Chemistry and SolidState Physics
 AntiAdiabatic State  Ground Electronic State of Superconductors
 Delocalization Effects in Pristine and Oxidized Graphene Substrates
 A Review of Bonding in Dendrimers and NanoTubes
 20Nanogold Td and LowEnergy Hollow Cages: Void Reactivity
 A Theoretical Study of Complexes of Crown Ethers with Substituted Ammonium Cations
 Systematic Derivation and Testing of AMBER Force Field Parameters for Fatty Ethers from Quantum Mechanical Calculations
 Theoretical Studies on MetalContaining Artificial DNA Bases
 Isbn
 9789400720763
 Label
 Advances in the Theory of Quantum Systems in Chemistry and Physics
 Title
 Advances in the Theory of Quantum Systems in Chemistry and Physics
 Statement of responsibility
 edited by Philip E. Hoggan, Erkki J. Brändas, Jean Maruani, Piotr Piecuch, Gerardo DelgadoBarrio
 Language

 eng
 eng
 Summary
 Advances in the Theory of Quantum Systems in Chemistry and Physics is a collection of 32 selected papers from the scientific contributions presented at the 15th International Workshop on Quantum Systems in Chemistry and Physics (QSCPXV), held at Magdalene College, Cambridge, UK, from August 31st to September 5th, 2010. This volume discusses the state of the art, new trends, and the future of methods in molecular quantum mechanics and their applications to a wide range of problems in chemistry, physics, and biology. The breadth and depth of the scientific topics discussed during QSCPXV are gathered in seven sections: I. Fundamental Theory; II. Model Atoms; III. Atoms and Molecules with ExponentialType Orbitals; IV. DensityOriented Methods; V. Dynamics and Quantum MonteCarlo Methodology; VI. Structure and Reactivity; VII. Complex Systems, Solids, Biophysics. Advances in the Theory of Quantum Systems in Chemistry and Physics is written for research students and professionals in Quantum systems of chemistry and physics. It also constitutes and invaluable guide for those wishing to familiarise themselves with research perspectives in the domain of quantum systems for thematic conversion or simply to gain insight into the methodological developments and applications to physics chemistry and biology that have actually become feasible by the end of 2010
 Dewey number
 541/.2
 http://bibfra.me/vocab/relation/httpidlocgovvocabularyrelatorsedt

 R1TV6pMzrLw
 OmvnTB2mD8
 tyL_uHrOQnQ
 keMKDKxl2MU
 acCgAmncHJ8
 Language note
 English
 LC call number
 QD450801
 Literary form
 non fiction
 Nature of contents
 dictionaries
 http://library.link/vocab/relatedWorkOrContributorName

 Hoggan, Philip E.
 Brändas, Erkki J.
 Maruani, Jean.
 Piecuch, Piotr.
 DelgadoBarrio, Gerardo.
 Series statement
 Progress in Theoretical Chemistry and Physics,
 Series volume
 22
 http://library.link/vocab/subjectName

 Chemistry
 Chemistry, Physical organic
 Theoretical and Computational Chemistry
 Physical Chemistry
 Label
 Advances in the Theory of Quantum Systems in Chemistry and Physics, edited by Philip E. Hoggan, Erkki J. Brändas, Jean Maruani, Piotr Piecuch, Gerardo DelgadoBarrio, (electronic resource)
 Note
 Description based upon print version of record
 Bibliography note
 Includes bibliographical references and index
 Carrier category
 online resource
 Carrier category code
 cr
 Content category
 text
 Content type code
 txt
 Contents
 Time Asymmetry and the Evolution of Physical Laws  SpatiallyDependentMass Schrödinger Equations with Morse Oscillator Eigenvalues: Isospectral Potentials and Factorization Operators  Relativistic Theory of Cooperative MuonNuclear Processes: Negative Muon Capture and Metastable Nucleus Discharge  TwoRange Addition Theorem for Coulomb Sturmians  Why Specific ETOs are Advantageous for NMR and Molecular Interactions  Progress in HylleraasCI Calculations on Boron  Structural and Electronic Properties of Polonium under Hydrostatic Pressure  Complexity Analysis of the Hydrogenic Spectrum in Strong Fields  Atomic Density Functions: Atomic Physics Calculations Analyzed with Methods from Quantum Chemistry  Understanding Maximum Probability Domains with Simple Models  Density Scaling for Excited States  Finite Element Method in DFT Electronic Structure Calculations  Shifts in Excitation Energies Induced by Hydrogen Bonding: A Comparison of the Embedding and Supermolecular TimeDependent DFT Calculations with the EquationofMotion CoupledCluster Results  Multiparticle Distribution of Fermi Gas System in Any Dimension  Hierarchical EffectiveMode Approach for Extended Molecular Systems  ShortTime Dynamics through Conical Intersections in Macrosystems: Quadratic Coupling Extension  Theoretical Methods for Nonadiabatic Dynamics “on the fly” in Complex Systems and its Control by Laser Fields  A Survey on Reptation Quantum Monte Carlo  Quantum Monte Carlo Calculations of Electronic Excitation Energies: the Case of the Singlet n → (CO) Transition in Acrolein  Analysis of the ChargeTransfer Mechanism in IonMolecule Collisions  Recombination by Electron Capture in the Interstellar Medium  Systematic Exploration of Chemical Structures and Reaction Pathways on the Quantum Chemical Potential Energy Surface by Means of the Anharmonic Downward DistortionFollowing Method  Neutral Hydrolysis of Methyl Formate from Abinitio Potentials and Molecular Dynamics Simulation  Radial Coupling and Adiabatic Correction for the LiRb Molecule  CentreofMass Separation in Quantum Mechanics: Implications for the ManyBody Treatment in Quantum Chemistry and SolidState Physics  AntiAdiabatic State  Ground Electronic State of Superconductors  Delocalization Effects in Pristine and Oxidized Graphene Substrates  A Review of Bonding in Dendrimers and NanoTubes  20Nanogold Td and LowEnergy Hollow Cages: Void Reactivity  A Theoretical Study of Complexes of Crown Ethers with Substituted Ammonium Cations  Systematic Derivation and Testing of AMBER Force Field Parameters for Fatty Ethers from Quantum Mechanical Calculations  Theoretical Studies on MetalContaining Artificial DNA Bases
 Dimensions
 unknown
 Edition
 1st ed. 2012.
 Extent
 1 online resource (629 p.)
 Form of item
 online
 Isbn
 9789400720763
 Media category
 computer
 Media type code
 c
 Other control number
 10.1007/9789400720763
 Specific material designation
 remote
 System control number

 (CKB)2550000000065700
 (EBL)886011
 (OCoLC)764633456
 (SSID)ssj0000595744
 (PQKBManifestationID)11362515
 (PQKBTitleCode)TC0000595744
 (PQKBWorkID)10571937
 (PQKB)11449440
 (DEHe213)9789400720763
 (MiAaPQ)EBC886011
 (EXLCZ)992550000000065700
 Label
 Advances in the Theory of Quantum Systems in Chemistry and Physics, edited by Philip E. Hoggan, Erkki J. Brändas, Jean Maruani, Piotr Piecuch, Gerardo DelgadoBarrio, (electronic resource)
 Note
 Description based upon print version of record
 Bibliography note
 Includes bibliographical references and index
 Carrier category
 online resource
 Carrier category code
 cr
 Content category
 text
 Content type code
 txt
 Contents
 Time Asymmetry and the Evolution of Physical Laws  SpatiallyDependentMass Schrödinger Equations with Morse Oscillator Eigenvalues: Isospectral Potentials and Factorization Operators  Relativistic Theory of Cooperative MuonNuclear Processes: Negative Muon Capture and Metastable Nucleus Discharge  TwoRange Addition Theorem for Coulomb Sturmians  Why Specific ETOs are Advantageous for NMR and Molecular Interactions  Progress in HylleraasCI Calculations on Boron  Structural and Electronic Properties of Polonium under Hydrostatic Pressure  Complexity Analysis of the Hydrogenic Spectrum in Strong Fields  Atomic Density Functions: Atomic Physics Calculations Analyzed with Methods from Quantum Chemistry  Understanding Maximum Probability Domains with Simple Models  Density Scaling for Excited States  Finite Element Method in DFT Electronic Structure Calculations  Shifts in Excitation Energies Induced by Hydrogen Bonding: A Comparison of the Embedding and Supermolecular TimeDependent DFT Calculations with the EquationofMotion CoupledCluster Results  Multiparticle Distribution of Fermi Gas System in Any Dimension  Hierarchical EffectiveMode Approach for Extended Molecular Systems  ShortTime Dynamics through Conical Intersections in Macrosystems: Quadratic Coupling Extension  Theoretical Methods for Nonadiabatic Dynamics “on the fly” in Complex Systems and its Control by Laser Fields  A Survey on Reptation Quantum Monte Carlo  Quantum Monte Carlo Calculations of Electronic Excitation Energies: the Case of the Singlet n → (CO) Transition in Acrolein  Analysis of the ChargeTransfer Mechanism in IonMolecule Collisions  Recombination by Electron Capture in the Interstellar Medium  Systematic Exploration of Chemical Structures and Reaction Pathways on the Quantum Chemical Potential Energy Surface by Means of the Anharmonic Downward DistortionFollowing Method  Neutral Hydrolysis of Methyl Formate from Abinitio Potentials and Molecular Dynamics Simulation  Radial Coupling and Adiabatic Correction for the LiRb Molecule  CentreofMass Separation in Quantum Mechanics: Implications for the ManyBody Treatment in Quantum Chemistry and SolidState Physics  AntiAdiabatic State  Ground Electronic State of Superconductors  Delocalization Effects in Pristine and Oxidized Graphene Substrates  A Review of Bonding in Dendrimers and NanoTubes  20Nanogold Td and LowEnergy Hollow Cages: Void Reactivity  A Theoretical Study of Complexes of Crown Ethers with Substituted Ammonium Cations  Systematic Derivation and Testing of AMBER Force Field Parameters for Fatty Ethers from Quantum Mechanical Calculations  Theoretical Studies on MetalContaining Artificial DNA Bases
 Dimensions
 unknown
 Edition
 1st ed. 2012.
 Extent
 1 online resource (629 p.)
 Form of item
 online
 Isbn
 9789400720763
 Media category
 computer
 Media type code
 c
 Other control number
 10.1007/9789400720763
 Specific material designation
 remote
 System control number

 (CKB)2550000000065700
 (EBL)886011
 (OCoLC)764633456
 (SSID)ssj0000595744
 (PQKBManifestationID)11362515
 (PQKBTitleCode)TC0000595744
 (PQKBWorkID)10571937
 (PQKB)11449440
 (DEHe213)9789400720763
 (MiAaPQ)EBC886011
 (EXLCZ)992550000000065700
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