QuantumATK Forum

QuantumATK => General Questions and Answers => Topic started by: asu on November 15, 2018, 22:48

Title: Sr2CoFeO6
Post by: asu on November 15, 2018, 22:48

 Respect Quantumwise team

How to build Sr2CoFeO6  structure and calculate lattice parameter.

Thanks

Title: Re: Sr2CoFeO6
Post by: Petr Khomyakov on November 15, 2018, 23:55

Try searching internal and external databases available through QuantumATK NanoLab, see https://docs.quantumwise.com/tutorials/builder_manual/builder_import/builder_import.html.

For geometry optimization, please take a look at this tutorial,https://docs.quantumwise.com/tutorials/geometry_optimization/geometry_optimization.html.