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| [EN CONSTRUCCION]
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| * Consider: | | * Consider: |
| # a cubic simulation box whose sides are of length <math>\left. L \right. </math> | | # a cubic simulation box whose sides are of length <math>\left. L \right. </math> |
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| *<math> \alpha = \beta = \gamma = 90^0 </math> | | *<math> \alpha = \beta = \gamma = 90^0 </math> |
| | [[category: computer simulation techniques]] |
- a cubic simulation box whose sides are of length
- a number of lattice positions, given by ,
with being a positive integer
- The positions are those given by:
where the indices of a given valid site are integer numbers that must fulfill the following criteria
- ,
- the sum of can have only the values: 0, 3, 4, 7, 8, 10, ...
i.e, ; OR; , with being
any integer number
- the indices must be either all even or all odd.
with
Atomic position(s) on a cubic cell[edit]
- Number of atoms per cell: 8
- Coordinates:
Atom 1:
Atom 2:
Atom 3:
Atom 4:
Atom 5:
Atom 6:
Atom 7:
Atom 8:
Cell dimensions: