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| == F77 General Programs == | | === Fortran77 === |
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| * RADIAL DISTRIBUTION FUNCTION (RDF) | | * [[Radial Distribution Function]] |
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| You can find the definition of RDF in the following:
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| http://rings-code.sourceforge.net/index.php?option=com_content&view=article&id=50:rdf&catid=36:phy-chi&Itemid=58
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| '''Name''': ''x.RDF''
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| '''Launching''': ''x.RDF > output'' (in ''output'' some details of the calculation are reported)
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| '''Output file''': ''Global.dat'', ''fort.X'' (see below)
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| '''Used files/subprograms''': ''none''
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| == INSTALLATION STEPS ==
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| 1) First of all, download the program:
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| [[Image:Cell.tgz]]
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| uncompress it and compile it: ''f77 Cell.f -o x.Cell''. Place it in a directory of your choice (for simplicity, named directory A).
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| 2) Download the script:
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| [[Image:ngeom.tgz]]
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| and uncompress it.
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| 3) CHANGE IN LINE 14 OF ''ngeom.sh'' ''path=/home/lbellarosa/src/complex/Cell'' with the path of where you put your directory A.
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| 4) Now you can run the script typing:
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| ngeom.sh OUTCAR
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Latest revision as of 17:58, 19 January 2011