[Pw_forum] 答复: [Pw_forum] why I can not get the correct band gap of TiO2?

Paolo Giannozzi giannozz at nest.sns.it
Wed Oct 26 18:36:30 CEST 2005


On Wednesday 26 October 2005 18:03, #TAO JUNGUANG# wrote:

> [...] can you tell how to use bands.x and forthmore band_plot.x
> to plot the band structure? Thanks 

there is an example of band structure plotting in examples/example05

P.
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Paolo Giannozzi             e-mail:  giannozz at nest.sns.it
Scuola Normale Superiore    Phone:   +39/050-509876, Fax:-563513 
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