[DFTB-Plus-User] question on waveplot to tiorg-0-1

[taoohee]

Dear all,

I want to plot the orbital wavefunction of bulk TiO2 which was calculated with the "tiorg-0-1" parameter set downloaded from DFTB website, but i cant found the wavefunction coefficient filie (e.g., "wfc.tiorg-0-1.hsd"). Anybody can help me? Moreover, whether the "wfc.trans3d-0-1" could work for "tiorg-0-1' parameter set ?

Thanks for any reply!


2011-04-28 



taoohee 
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