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. 2019 Apr 16;141(18):7399–7406. doi: 10.1021/jacs.9b01267

Figure 3.

Figure 3

Calculated adsorption geometries and simulated AFM images of the initial 1a, intermediate 4, and final product 3a of TNTP-tBu on Cu(110). (a, b, e, f, i, j) Top and side views of the calculated adsorption geometries of an initial molecule (a, b), an intermediate (e, f), and a final product molecule (i, j) on Cu(110). The C, H, first layer Cu, and bulk Cu atoms are represented by the black, blue, violet, and red spheres, respectively. (c, g, k) Simulated constant-height AFM images of an initial molecule (c), an intermediate (g), and a final product molecule (k) adsorbed on Cu(110). (d, h, l) Experimental constant-height AFM images of an initial molecule (d), an intermediate (h), and a final product molecule (l) adsorbed on Cu(110). Imaging parameters: images (d, h, and l) are the same as Figure 2g, h, and i.