Methods in Computational Molecular Physics
This NATO Advanced Study Institute was concerned with modern ab initio methods for the determination of the electronic structure of molecules. Recent years have seen considerable progress in computer technology and computer science and these developments have had a very significant influence on comp...
| Other Authors: | , |
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| Format: | eBook |
| Language: | English |
| Published: |
Dordrecht
Springer Netherlands
1983, 1983
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| Edition: | 1st ed. 1983 |
| Series: | Nato Science Series C:, Mathematical and Physical Sciences
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| Subjects: | |
| Online Access: | |
| Collection: | Springer Book Archives -2004 - Collection details see MPG.ReNa |
Table of Contents:
- Molecular Integrals for Gaussian Type Functions
- On the Evaluation of Exponential (Slater) Type Integrals
- Basis Sets
- Matrix Eigenvector Methods
- Group Theory Applied to CI Methods
- The Multiconfigurational (MC) SCF Method
- The Direct CI Method
- Pair Correlation Theories
- On a Green’s Function Method for the Calculation of Ionization Spectra in the Outer and Inner Valence Region
- Introductory Polarization Propagator Theory
- Diagrammatic Many-Body Perturbation Theory
- Schrödinger Spectra
- Computers and Computation in Molecular Physics
- Participants