head Test calculation: Lattice invariance shear of cubic crystal

% Set convergence tolerance for CG
fact,gtol,1e-16

% read in material definitions
mate,dire
 'Cu(fcc)'
  0 2 2
 2 0 2
 2 2 0

  1
  29 0 0 0 
  1

% read in constitutive information
cons,kim,EAM_Dynamo_Hoyt_Garvin_PbCu__MO_119135752160_004

% Find optimal lattice parameters and reset lattice
opti,,1

% Compute energy, stress, moduli stepping to final deformation gradient
% defo,dire,,nrlx,mult,100
% If the cb-kim code include perturbation use the following command
defo,dire,,nrlx,,mult,100
0.5 -0.5 -0.5
0.5 1.5 0.5
0.0 0.0 1.0

end
stop