[Wien] Temperature
Brik Hamida
hmd.brik at gmail.com
Wed Jul 6 01:11:26 CEST 2022
Dear
I Explain my point of view :
Using Wien2k code all calculations are done at 0 kelvin . So there is no
thermal energy able to displace an electron from valence to conduction
band. Conduction bands levels are therefore empty.if for example the
Wien2k-estimated bandgap is of 2 eV so it is considered as semiconductor
. so is it logical to speak of energy conduction level and wien2k
calculates the density of charges /states in conduction band namely DOS
and we know that at T=0k the material is insulator so no electron in
conduction band.
my second question :with respect to semiconductor definition, it is
conductor at ambient temperature so KT=25 meV . do you think that this
energy it sufficent to displace the electron from VB to CB with Eg =2 eV.?
Best regards
Brik
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