QuantumATK Forum

QuantumATK => General Questions and Answers => Topic started by: hsharma on January 8, 2017, 20:49

Title: Hexagonal (wurtzite Structure) database
Post by: hsharma on January 8, 2017, 20:49

Dear Sir,

Would it be possible to keep Hexagonal (wurtzite Structure) like CdS, CdSe, SiC etc. in the database so that it will be easier for us to create the nano particles with hexagonal symmetry.

Thanks
Henu.

Title: Re: Hexagonal (wurtzite Structure) database
Post by: Petr Khomyakov on January 9, 2017, 08:11

You may find those structures in the Crystallography Open Database.  In the Builder, go to Add->From Plugin->Crystallography Open database, and then search for materials comprised of Si and C chemical elements to find and add to the Stash the one you are interested in, e,g., hexagonal structure of SiC. The same can be done for CdS and CdSe.

Title: Re: Hexagonal (wurtzite Structure) database
Post by: hsharma on January 9, 2017, 12:46

Thank you.