Molecular aggregation : structure analysis and molecular simulation of crystals and liquids
Guardado en:
| Autor principal: | |
|---|---|
| Formato: | Libro |
| Lenguaje: | Inglés |
| Publicado: |
Oxford :
Oxford University Press,
2007
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| Colección: | International Union of Crystallography monographs on crystallography ;
19 |
| Materias: | |
| Aporte de: | Registro referencial: Solicitar el recurso aquí |
Tabla de Contenidos:
- 1 The molecule: structure, size and shape
- 2 Molecular vibrations and molecular force fields
- 3 Quantum chemistry
- 4 The physical nature and the computer simulation of the intermolecular potential
- 5 Crystal simmetry and X-ray diffraction
- 6 Periodic systems:Crystal orbitals and lattice dynamics
- 7 Molecular structure and macroscopie properties: calorimetry and thermodynamics
- 8 Correlation studies in organic solids
- 9 The liquid state
- 10 Computers
- 11 Structure-property and structure-activity relationships
- 12 Intermolecular bonding
- 13 Phase equilibria, phase changes, and mesophases: Analysis and simulation
- 14 Crystal polymorphism and crystal structure prediction
- 15 Epilogue: a theory of crystallization?
- Supplementary material