Dear All
I am doing total energy calculation of body centered tetragonal structure. but I am not getting the same stress along a and b direction ( XX and YY component in stress matrix). I have given the atomic position in angstrom. relaxed the structure but still i didn't get the symmetry in stress. Thanks in advance -- Mayank BHABHA ATOMIC RESEARCH CENTER MUMBAI, INDIA Office: 022-25595606 Home: 9920397437 / 9869834437
