Dear experts, How, could one derive the Hamiltonian of a given system resulting in energy eigenvalues (band structure) *through the modules or subroutines* included in Q. E. integrated suite?
Is there anyway for this end? For example, if I provide an input scf file, how could I figure out what Hamiltonian will be used in my calculations? How could I make a change in the Hamiltonian of a system by manipulating subroutines (not the input file)? *--* *Regards,* *Ashkan Shekaari* *Plasma Physics Research Center* *Science and Research Branch* *I A U, 14778-93855 Tehran, Iran.*
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