ali kazempoor wrote: > I am working on nanowire and i want to know about > dangling bond on nanowire lateral facets. can i view > or analyze orbitals shape on nanowire facets by pp.x?
you can make 2-d contous plots or 3-d isosurface plots of any wavefunction. Of course you have to pick the interesting ones in the interesting region of space Paolo -- Paolo Giannozzi, Democritos and University of Udine, Italy
