[Pw_forum] Visualzing Atomic Orbitals
mhegde at uwaterloo.ca
Sat Dec 28 21:22:31 CET 2013
I would like to visualize atomic orbital orientaton across the crystal
growth direction in beta phase Ga2O3 syatem (b-direction). Is there any way
to do it using quantum espresso?. I have done the charge density plot. I
think that gives more information about bonding in crystals. Is it possible
to do it using projected density of states?. Any good suggestions?
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