Hello, it is explained in detail during the lectur of the second day of this school: http://media.quantum-espresso.org/santa_barbara_2009_07/
kind regards On Tuesday, July 19, 2016 1:30:53 PM CEST Mofrad, Amir Mehdi (MU-Student) wrote: > Dear all, > > > I was wondering if someone could show the procedure of calculating the bulk > modulus for a material in Quantum Espresso (for instance zeolite). > > > Best, > > > Amir M. Mofrad > > Graduate Research Assistant > > Chemical Engineering Department > > University of Missouri -- Dr. Lorenzo Paulatto IdR @ IMPMC -- CNRS & Université Paris 6 phone: +33 (0)1 44275 084 / skype: paulatz www: http://www-int.impmc.upmc.fr/~paulatto/ mail: 23-24/4é16 Boîte courrier 115, 4 place Jussieu 75252 Paris Cédex 05 _______________________________________________ Pw_forum mailing list Pw_forum@pwscf.org http://pwscf.org/mailman/listinfo/pw_forum