[TCOD] [SPAM] Re: What structures do we accept to TCOD?

[Armel le Bail]

Hi,

So, finally, it is more comparing (often) a DFT structure at OK but having
the cell parameters from an experimental structure at 293K to that  
experimental
structure rather than comparing apples and bananas.

Would be time to make the effort to have DFT results at any temperature
including the phase transition predictions. I am sure you also dream  
of that...

Best,
Armel