CELL

NAME
CELL - Define the initial lattice for the solvent
SYNOPSIS
CELL type
DESCRIPTION
This command defines the Bravais lattice type to be used when generating a solvent lattice with GENERATE. type may be BCC, FCC, or SC, corresponding to Body Centered Cubic, Face Centered Cubic, and Simple Cubic lattices, respectively.
EXAMPLES
 
&SOLVENT
   CELL SC 
   GENERATE RANDOMIZE  4 4 4
   ....
&END


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procacci 2021-12-29