
% By the way, the INPUT-file is case insensitive, 
% I just happen to like capital letters ;-)


% you need to put here the MIKA-installation directory.

SET BASE_DIR "./"


SET STATES 4


% alternatives currently available are ZERO, MULTIPOLES, PERIODIC
SET BOUNDARY_CONDITIONS ZERO

% When doing a domain decomposition (DD) parallel calc:
% SET DD_DIMENSIONS 2 2 2 

SET OCC 4*2. 4*0.

% We will just do a quick and dirty test calculation 
% ( not very accurate )
SET GRID 19 19 19


% When no LATTICE_CONSTANT is given, the cell dimensions are
% assumed to be given  in atomic units (bohrs)
SET CELL 10. 10. 10.


% Then just a list of atoms. When no DISTANCE_UNIT 
% is given, atomic units (bohrs) are assumed 
ATOM C    .000 .000 .000   
ATOM H  1.185  1.185  1.185
ATOM H -1.185 -1.185  1.185
ATOM H -1.185  1.185 -1.185
ATOM H  1.185 -1.185 -1.185

