Dear Siesta users,
Recently, I have computed I-V characteristics of graphene oxide and Pt attached graphene oxide systems separately. It has been found that the current through Pt-graphene oxide is lesser as compared to that of the pure graphene oxide for all the bias voltage points up to 1 V.
But the result is expected to be opposite (as Pt-graphene oxide is more conductive practically).
Could anyone please suggest me, what wrong I have done in my calculations.
I have used readily available pseudo potentials for all atoms.
I am eagerly waiting for your valuable reply.
Thanking you in advance.
With regards,
Bibhas Manna