Brownian dynamics simulation of alkane chain reorientation: A comparison of models
Orientational time correlation functions and correlation times are determined using a Brownian dynamics and rigid body formalism and are compared with the results obtained from our previous Mori approach. It is found that the Mori method equipped with a minimum set of primary variables approximately...
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| Veröffentlicht in: | The Journal of chemical physics 1980-01, Vol.72 (3), p.1504-1511 |
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| Hauptverfasser: | , |
| Format: | Artikel |
| Sprache: | eng |
| Online-Zugang: | Volltext |
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