Dear Espresso community I wanted to ask whether there is any information on sp3 and sp2 hybridized C atoms or on which bonds are double in the output of QE (I guess that the answer is 'no', but I wanted to be sure).
Thank you very much. With kind regards. -- -- Dr. Pablo García Risueño
_______________________________________________ Quantum ESPRESSO is supported by MaX (www.max-centre.eu/quantum-espresso) users mailing list [email protected] https://lists.quantum-espresso.org/mailman/listinfo/users
