head Test calculation: Stillinger-Weber silicon ground state and compression

% Set convergence tolerance for CG
fact,gtol,1e-16
  
% read in material definitions
mate,dire
 'sed_species_string(sed_type_string)'
  sed_latticematrix
  sed_nbasis
  sed_basispos
  sed_mass
  
% read in constitutive information
cons,kim,sed_model_string

% check equilibrium
equi,,  
% Find optimal lattice parameters and reset lattice
opti,,1

% Apply deformation gradient
defo,dire,,relx,,sing
1 0 0
0 1 0
0 0 1
  
end
stop