import "spce.lt" # Periodic boundary conditions: write_once("Data Boundary") { 0.0 34.50 xlo xhi 0.0 34.50 ylo yhi 0.0 34.50 zlo zhi } # The next command generates a (rather dense) cubic lattice with # spacing 3.45 Angstroms. (The pressure must be equilibrated later.) wat = new SPCE [4].move(0.00, 0.00, 3.45) [4].move(0.00, 3.45, 0.00) [4].move(3.45, 0.00, 0.00)