Difference between revisions of "Hauptseminar Moderne Simulationsmethoden WS 2009/Langreichweitige Wechselwirkungen II"
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| − | + | {{Seminartopic | |
| − | date= | + | |date=2010 |
| − | topic=Langreichweitige Wechselwirkungen in periodischen Geometrien II: MMM und schnelle Multipol Methoden (FMM) | + | |topic=Langreichweitige Wechselwirkungen in periodischen Geometrien II: MMM und schnelle Multipol Methoden (FMM) |
| − | speaker= | + | |speaker= |
| − | tutor= | + | |tutor=Alexey Neelov |
| − | + | }} | |
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| − | == Literatur, FMM == | + | == Literatur, FMM (Fast Multipole Method) == |
| − | + | A simpler version of the algorithm, to get the idea: | |
| − | + | H.-Q. Ding, N. Karasawa, and W. Goddard, J. Chem Phys, 97, 4309-4315, 1992. | |
Recent review: | Recent review: | ||
J. Kurzak, B.M. Pettitt, Mol. Simul. 32(10-11), pp.775-790 (2006). | J. Kurzak, B.M. Pettitt, Mol. Simul. 32(10-11), pp.775-790 (2006). | ||
| − | == Literatur, MMM == | + | A good paper: C. A. White and M. Head-Gordon, J. Chem. Phys. 101, 6593 (1994). |
| + | |||
| + | Book: S. Pfalzner and P. Gibbon, Many-body tree methods in physics (Cambridge University Press, 1996). | ||
| + | |||
| + | The paper where FMM was introduced: | ||
| + | L. Greengard and V. Rokhlin, J. Comput. Phys. 73, pp. 325-348 (1987). | ||
| + | |||
| + | FMM is so famous that it is in the Wikipedia: | ||
| + | http://en.wikipedia.org/wiki/Fast_multipole_method | ||
| + | |||
| + | ..and considered to be one of 10 greatest algorithms of the 20th century: | ||
| + | http://amath.colorado.edu/resources/archive/topten.pdf | ||
| + | |||
| + | == Literatur, MMM (M-Body Method) (optional?)== | ||
Review by Arnold and Holm (good starting point): | Review by Arnold and Holm (good starting point): | ||
http://springerlink.com/content/965j2ev8rc9wlld3/?p=a413f88a65324fd9bf31cc0d04e171d2&pi=1 | http://springerlink.com/content/965j2ev8rc9wlld3/?p=a413f88a65324fd9bf31cc0d04e171d2&pi=1 | ||
| Line 39: | Line 51: | ||
ftp://ftp.inf.ethz.ch/pub/publications/diss/th13504.pdf | ftp://ftp.inf.ethz.ch/pub/publications/diss/th13504.pdf | ||
| − | + | [[Category:Hauptseminar WS2009]] | |
Latest revision as of 10:59, 2 July 2012
- "{{{number}}}" is not a number.
- Date
- 2010
- Topic
- Langreichweitige Wechselwirkungen in periodischen Geometrien II: MMM und schnelle Multipol Methoden (FMM)
- Speaker
- Tutor
- Alexey Neelov
Literatur, FMM (Fast Multipole Method)
A simpler version of the algorithm, to get the idea: H.-Q. Ding, N. Karasawa, and W. Goddard, J. Chem Phys, 97, 4309-4315, 1992.
Recent review: J. Kurzak, B.M. Pettitt, Mol. Simul. 32(10-11), pp.775-790 (2006).
A good paper: C. A. White and M. Head-Gordon, J. Chem. Phys. 101, 6593 (1994).
Book: S. Pfalzner and P. Gibbon, Many-body tree methods in physics (Cambridge University Press, 1996).
The paper where FMM was introduced: L. Greengard and V. Rokhlin, J. Comput. Phys. 73, pp. 325-348 (1987).
FMM is so famous that it is in the Wikipedia: http://en.wikipedia.org/wiki/Fast_multipole_method
..and considered to be one of 10 greatest algorithms of the 20th century: http://amath.colorado.edu/resources/archive/topten.pdf
Literatur, MMM (M-Body Method) (optional?)
Review by Arnold and Holm (good starting point): http://springerlink.com/content/965j2ev8rc9wlld3/?p=a413f88a65324fd9bf31cc0d04e171d2&pi=1
The MMM2D method: A. Arnold, C. Holm, Comput. Phys. Commun. 148(3), pp. 327-348 (2002)
The MMM1D method: A. Arnold, C. Holm, J. Chem. Phys. 123, 144103 (2005)
PhD thesis of Axel Arnold: http://deposit.ddb.de/cgi-bin/dokserv?idn=975904000&dok_var=d1&dok_ext=pdf&filename=975904000.pdf
The MMM method:
R. Sperb, Mol. Simul. 20, pp.179-200 (1998)
R. Sperb, Mol. Simul. 22, pp.199-212 (1999)
R. Strebel and R. Sperb, Mol. Simul. 27, pp.61 -74 (2001)
PhD thesis of the author of MMM algorithm: ftp://ftp.inf.ethz.ch/pub/publications/diss/th13504.pdf