Most likely your TS.NumUsedAtomsLeft and TS.NumUsedAtomsRight variables do not indicate the correct number of atoms of the electrodes.
Riccardo ----- Original Message ----- From: "Manjeet bhatia" <[email protected]> To: [email protected] Sent: Sunday, July 1, 2012 9:40:03 AM Subject: [SIESTA-L] tbtrans sir, I am doing calculations with Au as two electrodes and BaTiO3 as scattering region.But error is "unexpected number of orbitals in left electrode ".Please can u tell me where is the problem.thank u. Manjeet Bhatia Research Scholar Pondicherry University India
