forked from lijiext/lammps
30 lines
1.2 KiB
Plaintext
30 lines
1.2 KiB
Plaintext
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Ipp is a Perl script for facilitating the creation of a complicated
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file (say, a lammps input file or tools/createatoms input file) using
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a template file.
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ipp was created and is maintained by Reese Jones (Sandia), rjones at
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sandia.gov.
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Example 1:
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If one has a template for a long lammps input file called
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"template_lammps.input" where a few parameters need to be changed. One
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can define these parameters in a short file called
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"fill_parameters_lammps.input" and execute "ipp -p
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fill_parameters_lammps.input template_lammps.input >
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lammps.input". The file "lammps.input" file will be the final lammps
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input file.
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Example 2:
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If one has a template for a long createAtoms input file called
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"template_createAtoms.input" that creates double elpasolite
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crystals. One wants to change the lattice constants and tilting angle
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of the octahedrons. One can define these parameters in a short file
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called "fill_parameters_createAtoms.input" and execute "ipp -p
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fill_parameters_createAtoms.input template_createAtoms.input >
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createAtoms.input". The "createAtoms.input" file will be the final
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createAtoms input file. If one has an excetable for createAtoms called
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"create", one can simply execute "create<createAtoms.input" to create
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the crystal that LAMMPS can read.
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