hello siesta user,
I am doing calculations of Smarium Sulphide (SmS) in ground state. It is
non-metallic at ambient pressure and temperature. But my calculations shows
that it is metallic, i.e in DOS plot, Fermi energy is not empty. Why this
happens i unable to understand. I am sending the sms
hello siesta user,
I am doing calculations of Smarium Sulphide (SmS) in ground state. It is
non-metallic at ambient pressure and temperature. But my calculations shows
that it is metallic, i.e in DOS plot, Fermi energy is not empty. Why this
happens i unable to understand. I am sending the sms
2 matches
Mail list logo