examples:potentials
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examples:potentials [2018/01/10 17:35] – ↷ Links adapted because of a move operation daniel | examples:potentials [2018/01/10 18:21] – daniel | ||
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Starting potentials for analytic potentials can be generated with the | Starting potentials for analytic potentials can be generated with the | ||
- | [[:utilities_awk_scripts# | + | [[utilities:awk_scripts# |
There are several examples available for the different interactions: | There are several examples available for the different interactions: | ||
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| 1 | none | [[examples: | | 1 | none | [[examples: | ||
| 2 | global parameters | [[examples: | | 2 | global parameters | [[examples: | ||
- | | 2 | smooth cutoff | [[:examples_potentials_pair_3|Example 3]] | | + | | 2 | smooth cutoff | [[examples:potentials: |
- | | 2 | chemical potentials | [[:examples_potentials_pair_4|Example 4]] | | + | | 2 | chemical potentials | [[examples:potentials: |
- | | 2 | fixed parameters | [[:examples_potentials_pair_5|Example 5]] | | + | | 2 | fixed parameters | [[examples:potentials: |
- | | 3 | invariant potentials | [[:examples_potentials_pair_6|Example 6]] | | + | | 3 | invariant potentials | [[examples: |
==== EAM potentials ==== | ==== EAM potentials ==== | ||
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^ # atom types ^ special features ^ Link ^ | ^ # atom types ^ special features ^ Link ^ | ||
- | | 1 | global smooth cutoff | [[:examples_potentials_eam_1|Example 1]] | | + | | 1 | global smooth cutoff | [[examples:potentials: |
- | | 2 | smooth cutoff | [[:examples_potentials_eam_2|Example 2]] | | + | | 2 | smooth cutoff | [[examples:potentials: |
- | | 3 | invariant potentials | [[:examples_potentials_eam_3|Example 3]] | | + | | 3 | invariant potentials | [[examples:potentials: |
==== ADP potentials ==== | ==== ADP potentials ==== | ||
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^ # atom types ^ special features ^ Link ^ | ^ # atom types ^ special features ^ Link ^ | ||
- | | 1 | | [[:examples_potentials_adp_1|Example 1]] | | + | | 1 | | [[examples:potentials: |
- | | 2 | | [[:examples_potentials_adp_2|Example 2]] | | + | | 2 | | [[examples:potentials: |
==== Coulomb potentials ==== | ==== Coulomb potentials ==== | ||
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^ # atom types ^ special features ^ Link ^ | ^ # atom types ^ special features ^ Link ^ | ||
- | | 1 | | [[:examples_potentials_meam_1|Example 1]] | | + | | 1 | | [[examples:potentials: |
- | | 2 | | [[:examples_potentials_meam_2|Example 2]] | | + | | 2 | | [[examples:potentials: |
==== Stillinger-Weber potentials ==== | ==== Stillinger-Weber potentials ==== | ||
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^ # atom types ^ special features ^ Link ^ | ^ # atom types ^ special features ^ Link ^ | ||
- | | 1 | | [[:examples_potentials_stiweb_1|Example 1]] | | + | | 1 | | [[examples:potentials: |
- | | 2 | | [[:examples_potentials_stiweb_2|Example 2]] | | + | | 2 | | [[examples:potentials: |
- | | 3 | | [[:examples_potentials_stiweb_3|Example 3]] | | + | | 3 | | [[examples:potentials: |
==== Tersoff potentials ==== | ==== Tersoff potentials ==== | ||
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^ # atom types ^ special features ^ Link ^ | ^ # atom types ^ special features ^ Link ^ | ||
- | | 1 | | [[:examples_potentials_tersoff_1|Example 1]] | | + | | 1 | | [[examples:potentials: |
- | | 2 | | [[:examples_potentials_tersoff_2|Example 2]] | | + | | 2 | | [[examples:potentials: |
- | | 3 | | [[:examples_potentials_tersoff_3|Example 3]] | | + | | 3 | | [[examples:potentials: |
examples/potentials.txt · Last modified: 2018/09/19 17:50 by daniel