[Wien] using wien2k for structures contain defects, voids, ...

* >> >> ** ** >> >> ** ** >> -- >> >> *From:* wien-bounces at zeus.theochem.tuwien.ac.at [mailto: >> wien-bounces at zeus.theochem.tuwien.ac.at] *On Behalf Of ***ahmad**gharleghi >> *Sent:* Thursday, November 24, 2011 11:36 AM >&

[Wien] using wien2k for structures contain defects, voids, ...

*Dear all wien2K Users,* *I hope you are all happy.* *My question backs to possibility of running Wien2k for structures contain defects, voids or interstitial ions. * *Is it possible to make calculation for such structures?* *As I do remember, at least in the old version of wien2k, it was not p

[Wien] using wien2k for structures contain defects, voids, ...

[mailto:wien-bounces at zeus.theochem.tuwien.ac.at] On Behalf Of ahmad gharleghi Sent: Thursday, November 24, 2011 11:36 AM To: Wien at zeus.theochem.tuwien.ac.at Subject: [Wien] using wien2k for structures contain defects, voids, ... Dear all wien2K Users, I hope you are all happy. My question

[Wien] using wien2k for structures contain defects, voids, ...

* ** > > ** ** > -- > > *From:* wien-bounces at zeus.theochem.tuwien.ac.at [mailto: > wien-bounces at zeus.theochem.tuwien.ac.at] *On Behalf Of ***ahmad**gharleghi > *Sent:* Thursday, November 24, 2011 11:36 AM > *To:* Wien at z