Self-assembly of manganese phthalocyanine (MnPc) and iron phthalocyanine (FePc) molecules on Pb (111) and Au (111) surfaces is investigated by means of low-temperature scanning tunneling microscopy and density functional theory calculations.

2011年9月29日 · Binding configurations, interface electronic structures, and magnetic properties of 3 transition-metal phthalocyanine (Pc, where Mn, Fe, Co, Ni, Cu or Zn) molecular systems on a Au (111) substrate are systematically investigated with first-principles density functional theory calculations using the Perdew-Wang (PW91) exchange-correlation functio...

2018年8月24日 · Nevertheless, the molecule-surface binding energies can be correlated to the filling of 3d orbital in transition metal: MnPC and FePC display strongest interactions while smaller interaction ...

iron phthalocyanine (FePc) molecules on Pb(111) and Au(111) surfaces is investigated by means of low-temperature scanning tunneling micro- scopy and density functional theory calculations.

2011年9月29日 · Binding configurations, interface electronic structures, and magnetic properties of 3d-transition metal phthalocyanine (MPc, where M=Mn, Fe, Co, Ni, Cu or Zn) molecular systems on Au(111) substrate, are systematically investigated with first-principles density functional theory (DFT) calculations using PW91 exchange-correlation functional.

2025年1月21日 · We demonstrate the reversible control of interactions between a local molecular spin, hosted within an iron phthalocyanine (FePc) molecule, and the conduction electrons of a supporting Au(111) surf...

2011年5月11日 · Adsorption behavior of iron–phthalocyanine (FePc) at low submonolayer coverage on a reconstructed Au (111) single crystalline surface was investigated by a combination of low temperature scanning tunneling microscopy (STM) and density functional theory (DFT) calculations.

2016年3月9日 · Recent scanning tunneling microscopy experiments on electron transport through iron (II) phthalocyanine (FePc) molecules adsorbed on the Au (111) surface have revealed that the measured Kondo conductance signature depends strongly on the specific adsorption site.

2018年9月26日 · Herein, two emergent phenomena arising from such interactions, namely, the Kondo effect and magnetic anisotropy, are investigated theoretically in bilayer transition metal phthalocyanine (TMPc) (TM = Co, Fe) on a Pb (111) substrate by combining the density functional theory (DFT) and hierarchical equations of motion (HEOM) approaches.

2024年11月25日 · The FePc/nitrogen/boron-doped reduced graphene oxide (FePc-N-B/rGO) sensor can detect glutathione within a broad linear range (5.0 × 10 −8 M to 1.6 × 10 −3 M) and an impressively low detection limit (7.1 × 10 −9 M). Moreover, it offers excellent reproducibility, robust anti-interference capability, and long-term stability.