On Wed, 2013-12-11 at 10:29 -0600, Jan Gryko wrote: > Does symmetry determined by pw.x depend on euctwfc/ecutrho? > I am attaching two input files, T_30.in and T_50.in. > With ecutwfc=30, ecutrho=120 (file T_30.in), pw.x correctly finds 48 > symmetry operations, whereas > with ecutwfc=50, ecutrho=200 (file T_50.in) only 24 symmetry operations are > found. > > Any suggestions why?
http://www.quantum-espresso.org/wp-content/uploads/Doc/pw_user_guide/node19.html#SECTION000600190000000000000 See also the previous (5.0.0.18) and the following (5.0.0.20) item P. -- Paolo Giannozzi, Dept. Chemistry&Physics&Environment, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
