The transition temperatures and dynamics for the argon–xenon N=7 mixed cluster series
| Autor: | Franklin B. Brown, Daniel H. Robertson |
|---|---|
| Rok vydání: | 1990 |
| Předmět: |
Quenching
Argon Series (mathematics) Chemistry Transition temperature General Physics and Astronomy chemistry.chemical_element Noble gas Molecular physics Molecular dynamics Xenon Computer Science::Computer Vision and Pattern Recognition Cluster (physics) Physical chemistry Physical and Theoretical Chemistry |
| Zdroj: | The Journal of Chemical Physics. 93:702-710 |
| ISSN: | 1089-7690 0021-9606 |
| DOI: | 10.1063/1.459521 |
| Popis: | Results of molecular‐dynamics calculations with quenching for the N=7 Ar–Xe mixed cluster series are reported. The phase‐transition temperatures have been determined and are discussed. The microscopic transitions between catchment regions on the potential‐energy surface are examined as well as the total amount of time spent in each of these catchment regions. The mixed cluster results are compared to the homogeneous results. The heterogeneous dynamics are found to more closely reproduce the homogeneous results if the heterogeneous catchment regions are classified according to their associated homogeneous parent minimum. |
| Databáze: | OpenAIRE |
| Externí odkaz: |
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