hello dear colleague
I need some information about the calculation of band gap and band structure for YbMnO3 (hexagonal) and TbMnO3 compounds.
could you please calculate these points.
thanks a lot
Hi saebsadeghi,
Request fulfillment is paused at the moment due to a backend database overhaul, but we’ll be adding a property request system for bandstructures similar to the one we have in place for elastic tensors soon.