Dear siesta users,
I am doing quantum transport calculation on a
Fe(III) system placed between two gold electrodes. I plotted the projected
density of state that i got in tbtrans output file. Now i want figure out
that which density of states are metal d-orbitals. If anybody knows please
help. Your contribution will be highly appreciated.
--
Rupesh Kumar Tiwari
C/o: Prof. Gopalan Rajaraman
Junior Research Fellow (CSIR)
Department of Chemistry
IIT Bombay
Mumbai- 400076
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