]> hackdaworld.org Git - physik/posic.git/history - calc_delta_e
QUENCH feature (well, or sth like that ...)
[physik/posic.git] / calc_delta_e
2009-08-17 hackbarda modified posselt variation + the right one commented
2009-02-06 hackbardadded Posselt formation energy calc
2009-01-28 hackbardadded del_atoms, playing with Ef calc, some more TODO
2008-12-17 hackbardcleaned partial lattice create + added defect feature...
2007-10-04 hackbardauto read atom count
2007-10-02 hackbard3 methods of calculating interstitial formation energies
2007-08-16 hackbardadded very simple delta e calc script