. 2020 Sep 28;11(21):9038–9044. doi: 10.1021/acs.jpclett.0c02268

Table 1. Average Bond Distances from the Structure Shown in Figure 3c after Relaxation Compared to Corresponding Bond Distances in Bulk Cobalt Sulfides and Thiols on Au(111)^a.

structure	d_Au–S (Å)	d_{Co–S(bottom)} (Å)	d_Co–S(top) (Å)	d_Co–Co (Å)
CoS(0001)-like sheet/Au(111) T	2.57	2.24	2.25	3.43
bulk Co₃S₄^25,27 E	–	2.27	2.27	3.33
bulk CoS²⁶ E	–	2.33	2.33	3.37
thiols^28,29 T	2.63 (0.18)	–	–	–

Theoretically and experimentally obtained values are indicated with T and E, respectively.

Table 1. Average Bond Distances from the Structure Shown in Figure 3c after Relaxation Compared to Corresponding Bond Distances in Bulk Cobalt Sulfides and Thiols on Au(111)a.