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We extend the highly-parallelizable open-source electronic transport codeTRANSEC to perform real-space atomic-scale electronic transport calculationswith periodic boundary conditions in the lateral dimensions. We demonstrate theuse of TRANSEC in periodic Cu and Rh bulk structures and in large periodic Rhpoint contacts, in preparation to perform calculations of reflectionprobability across Rh grain boundaries.

Highly parallelizable electronic transport calculations in periodic Rhodium and Copper nanostructures