Computational Chemistry and Molecular Modeling : Principles and Applications /
| Autores principales: | , , |
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| Autor Corporativo: | |
| Formato: | eBook |
| Lenguaje: | English |
| Publicado: |
Berlin, Heidelberg :
Springer Berlin Heidelberg : Imprint: Springer,
2008.
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| Edición: | 1st ed. 2008. |
| Materias: |
Tabla de Contenidos:
- Symmetry and Point Groups
- Quantum Mechanics: A Brief Introduction
- Hückel Molecular Orbital Theory
- Hartree-Fock Theory
- Basis Sets
- Semiempirical Methods
- The Ab Initio Method
- Density Functional Theory
- Reduced Density Matrix
- Molecular Mechanics
- The Modeling of Molecules Through Computational Methods
- High Performance Computing
- Research in Computational Chemistry and Molecular Modeling
- Basic Mathematics for Computational Chemistry.