Fig. 2
From: In-situ formation of one-dimensional coordination polymers in molecular junctions
Molecular dynamics simulation demonstrating chaining mechanism. a, c Snapshots of the molecular dynamics simulations for the opening and the closing of the BdNC molecular junction, respectively, demonstrating the chaining effect in presence of extra BdNC molecule. b, d Reconstructed conductance traces along the corresponding DFT-MD trajectories. Numbered points correspond to the snapshots in (a, c)
