Dear all,
I read the paper exploring local currents in molecular juctions.
http://www.nature.com/nchem/journal/v2/n3/pdf/nchem.546.pdfI have few questions for this paper.
1.Is this paper's current used ATK package?
2.In the page 224 second paragraph, they are written " Arrows are coloured red when the transmission from the first atom to the second atom is positive and the second atom lies further along the transport direction, in this case from left to right; otherwaise they are coloured blue." The arrows means the transmission pathway used magnitude or angle?
3. And in this paper, the current could divide into sigma and pi systems, does ATK also could do the same thing?