Advances in the Theory of Atomic and Molecular Systems : Conceptual and Computational Advances in Quantum Chemistry
Quantum mechanics is the fundamental theory of matter on the microscopic scale. Thanks to conceptual advances and progress in computer technology, its application to the study of atomic and molecular systems, which is of relevance to chemistry, physics, biology, and materials science, is a rapidly d...
محفوظ في:
| المؤلف الرئيسي: | |
|---|---|
| مؤلفون آخرون: | , , |
| التنسيق: | Livre numérique |
| اللغة: | Anglais |
| منشور في: |
Dordrecht :
Springer Netherlands
[20..].
Cham : Springer Nature |
| الطبعة: | 1. |
| سلاسل: | Progress in Theoretical Chemistry and Physics
19 |
| الوصول للمادة أونلاين: | Accès sur la plateforme de l'éditeur Accès sur la plateforme Istex Accès Université d'Orléans Accès INSA CVL |
| ملاحظة: |
Archives Springer e-books (Licence nationale) Archives Springer e-books (Licence nationale) |
| Autres localisations: | Voir dans le Sudoc |
| Edition sous un autre format: | • Advances in the theory of atomic and molecular systems, Conceptual and computational advances in quantum chemistry, [Proceedings of the 13th international workshop on quantum systems in chemistry and physics (QSCP-XIII), held at Lansing, Michigan, USA, in july 2008], Dordrecht, Springer, 2009, 1 vol., Progress in theoretical chemistry and physics, 978-90-481-2595-1 • Advances in the Theory of Atomic and Molecular Systems, Texte imprimé, 9789048125975 • Advances in the Theory of Atomic and Molecular Systems, Texte imprimé, 9789400730502 |
جدول المحتويات:
- Historical Overviews An Illustrated Overview of the Origins and Development of the QSCP Meetings Methylene: A Personal Perspective High-Precision Quantum Chemistry Free Complement Method for Solving the Schrödinger Equation: How Accurately Can We Solve the Schrödinger Equation Energy Computation for Exponentially Correlated Four-Body Wavefunctions Beyond Nonrelativistic Theory: Relativity and QED The Equivalence Principle from a Quantum Mechanical Perspective Relativistically Covariant Many-Body Perturbation Procedure Relativistic Variational Calculations for Complex Atoms Advances in Wave Function Methods Linear Scaling Local Correlation Extensions of the Standard and Renormalized Coupled-Cluster Methods The Correlation Consistent Composite Approach (ccCA): Efficient and Pan-Periodic Kinetics and Thermodynamics On the Performance of a Size-Extensive Variant of Equation-of-Motion Coupled Cluster Theory for Optical Rotation in Chiral Molecules Performance of Block Correlated Coupled Cluster Method with the CASSCF Reference Function for Carbon Carbon Bond Breaking in Hydrocarbons Fermi-Vacuum Invariance in Multiconfiguration Perturbation Theory On the Wave Function of Coulson and Fischer: A Third Way in Quantum Chemistry Advances in Density Functional Theory Energy Densities of Exchange and Correlation in the Slowly Varying Region of the Airy Gas Orbital-Free Embedding Effective Potential in Analytically Solvable Cases A Simple Analytical Density Model for Atoms and Ions Based on a Semiexplicit Density Functional Advances in Concepts and Models The Jahn Teller Effect: Implications in Electronic Structure Calculations Rules for Excited States of Degenerate Systems: Interpretation by Frozen Orbital Analysis The Dissociation Catastrophe in Fluctuating-Charge Models and its Implications for the Concept of Atomic Electronegativity Information Planes and Complexity Measures for Atomic Systems, Ionization Processes and Isoelectronic Series