Fig. 3.
Compilation of orbitals reconstructed from ARPES data in this work. (Left) Experimental CBE ARPES maps of the PTCDA LUMO (A) and HOMO (B), and the pentacene LUMO (C), HOMO (D), and HOMO-1 (E). (Center) CBE maps with the recovered phase information. (Right) Reconstructed real-space orbitals (orange box) which are compared with corresponding Kohn–Sham orbital images obtained from density functional theory (without box). The wave function confinement regions are 14.8 × 7.2 Å2 and 14.8 × 5.4 Å2 for PTCDA and pentacene, respectively.