On Tue, 2014-12-30 at 20:17 +0900, BhattMahesh Datt wrote: > nat = 9
nine atoms > Be 0.000000000 -0.288675135 4.359667099 > Be 0.000000000 0.288675135 3.548485449 > Be 0.000000000 -0.288675135 2.754655986 > Be 0.000000000 ! ; 0.2886755135 1.965554700 > Be 0.000000000 0.288675135 1.965554700 > Be 0.000000000 -0.288675135 1.178901500 > Be 0.000000000 0.288675135 0.392919700 > Be 0.000000000 -0.288675135 -0.392919700 > Be 0.000000000 0.2886755135 -1.178901500 > Be 0.000000000 -0.288675135 -1.965554700 > Be 0.000000000 0.288675135 -2.754655986 > Be 0.000000000 ! -0.288675135 3.548485449 > Be 0.000000000 0.288675135 -4.359667099 thirteen atoms? Paolo -- Paolo Giannozzi, Dept. Chemistry&Physics&Environment, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222 _______________________________________________ Pw_forum mailing list [email protected] http://pwscf.org/mailman/listinfo/pw_forum
