## Abstract Review: 83 refs.
The single-configuration approximation in the calculation of the thermodynamic properties of microcrystalline clusters
โ Scribed by D.J. McGinty
- Publisher
- Elsevier Science
- Year
- 1972
- Tongue
- English
- Weight
- 353 KB
- Volume
- 13
- Category
- Article
- ISSN
- 0009-2614
No coin nor oath required. For personal study only.
โฆ Synopsis
The single-configuratio approximation that has been used in previous calculations of the thermodynamic prop erties of microcrystalline clusters can lead to quite significant errors in calculated values of the thermodynamic functions. The origin of the errors and methods by wblch they can be minimized are discussed in this note.
๐ SIMILAR VOLUMES
Calculation of the complete energy spectrum of the quantum system At3 is extremely difficult. The reason is the strong nonlinearity that entangles the modes of internal motion even at the lowest energy levels of the system. One can say that vibrations of the trimer are never small and that its vibra