Difference between revisions of "Fortgeschrittene Molekulardynamik III"
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date=t.b.a. | date=t.b.a. | ||
| − | topic=Fortgeschrittene Molekulardynamik III: | + | topic=Fortgeschrittene Molekulardynamik III: effiziente Simulation seltener Ereignisse |
speaker= | speaker= | ||
| − | tutor=[[ | + | tutor=[[Nadezhda Gribova]] |
</setdata> | </setdata> | ||
{{Seminartopic}} | {{Seminartopic}} | ||
| + | ;Required background: Statistical physics | ||
== Literatur == | == Literatur == | ||
| − | + | A review article: | |
| − | + | ||
| − | + | C. Dellago and P.G. Bolhuis, [http://comp-phys.univie.ac.at/fileadmin/CP/Publikationen/2008/Adv_Poly_Sci_2008.pdf"Transition Path Sampling and Other Advanced Simulation Techniques for Rare Events"], pp. 167-234 in the book: | |
| − | : | + | Advanced Computer Simulation Approaches for Soft Matter Sciences III; |
| + | Series: Advances in Polymer Science , Vol. 221, | ||
| + | Holm, Christian; Kremer, Kurt (Eds.), | ||
| + | 2009; ISBN: 978-3-540-87705-9 | ||
== Gliederungsvorschlag == | == Gliederungsvorschlag == | ||
| + | ;1. Introduction: Rare events, nucleation. | ||
| + | ;2. Order parameters to distinguish phases: | ||
| + | ;3. Simulation techniques for rare events | ||
| + | *Transition path ensemble | ||
| + | *Transition interface sampling | ||
| + | *Forward flux sampling | ||
| + | |||
| + | ;4 Applications | ||
Latest revision as of 16:48, 20 July 2009
<setdata> date=t.b.a. topic=Fortgeschrittene Molekulardynamik III: effiziente Simulation seltener Ereignisse speaker= tutor=Nadezhda Gribova </setdata>
- "{{{number}}}" is not a number.
- Date
- {{{date}}}"{{{date}}}" contains an extrinsic dash or other characters that are invalid for a date interpretation.
- Topic
- {{{topic}}}
- Speaker
- {{{speaker}}}
- Required background
- Statistical physics
Literatur
A review article:
C. Dellago and P.G. Bolhuis, "Transition Path Sampling and Other Advanced Simulation Techniques for Rare Events", pp. 167-234 in the book: Advanced Computer Simulation Approaches for Soft Matter Sciences III; Series: Advances in Polymer Science , Vol. 221, Holm, Christian; Kremer, Kurt (Eds.), 2009; ISBN: 978-3-540-87705-9
Gliederungsvorschlag
- 1. Introduction
- Rare events, nucleation.
- 2. Order parameters to distinguish phases
- 3. Simulation techniques for rare events
- Transition path ensemble
- Transition interface sampling
- Forward flux sampling
- 4 Applications