Intramolecularly resolved Kondo resonance of high-spin Fe ( II ) -porphyrin adsorbed on Au ( 111 )
Using cryogenic scanning tunneling microscopy, we measured the electronic states and Kondo resonance of single Fe(II)-porphyrin molecules adsorbed on a Au(111) surface with intramolecular resolution. We found that the Fe(II) ion introduces a spin-polarized molecular state near the Fermi level. Tunne...
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Veröffentlicht in: | Physical review. B, Condensed matter and materials physics Condensed matter and materials physics, 2015-01, Vol.91 (4), Article 045440 |
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container_title | Physical review. B, Condensed matter and materials physics |
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creator | Wang, Weihua Pang, Rui Kuang, Guowen Shi, Xingqiang Shang, Xuesong Liu, Pei Nian Lin, Nian |
description | Using cryogenic scanning tunneling microscopy, we measured the electronic states and Kondo resonance of single Fe(II)-porphyrin molecules adsorbed on a Au(111) surface with intramolecular resolution. We found that the Fe(II) ion introduces a spin-polarized molecular state near the Fermi level. Tunneling spectroscopy revealed that this state gives rise to Kondo resonance exhibiting characteristics different from those of the Fe(II) spin state. Spin-polarized density functional theory calculations revealed that the molecule was weakly adsorbed on the surface, yet still switches its spin configuration from S = 1 to 2. The spin switching was found to be driven by three effects: a structural distortion of the macrocyclic ring from planar to saddle shaped, a weak chemical bonding between the Fe and the Au surface atom underneath, and weakened Fe-N bonds due to Au(111)-molecule charge transfer. |
doi_str_mv | 10.1103/PhysRevB.91.045440 |
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The spin switching was found to be driven by three effects: a structural distortion of the macrocyclic ring from planar to saddle shaped, a weak chemical bonding between the Fe and the Au surface atom underneath, and weakened Fe-N bonds due to Au(111)-molecule charge transfer.</description><identifier>ISSN: 1098-0121</identifier><identifier>EISSN: 1550-235X</identifier><identifier>DOI: 10.1103/PhysRevB.91.045440</identifier><language>eng</language><subject>Charge transfer ; Chemical bonds ; Condensed matter ; Distortion ; Fermi level ; Iron ; Mathematical analysis ; Scanning tunneling microscopy ; Tunneling</subject><ispartof>Physical review. 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B, Condensed matter and materials physics</title><description>Using cryogenic scanning tunneling microscopy, we measured the electronic states and Kondo resonance of single Fe(II)-porphyrin molecules adsorbed on a Au(111) surface with intramolecular resolution. We found that the Fe(II) ion introduces a spin-polarized molecular state near the Fermi level. Tunneling spectroscopy revealed that this state gives rise to Kondo resonance exhibiting characteristics different from those of the Fe(II) spin state. Spin-polarized density functional theory calculations revealed that the molecule was weakly adsorbed on the surface, yet still switches its spin configuration from S = 1 to 2. The spin switching was found to be driven by three effects: a structural distortion of the macrocyclic ring from planar to saddle shaped, a weak chemical bonding between the Fe and the Au surface atom underneath, and weakened Fe-N bonds due to Au(111)-molecule charge transfer.</description><subject>Charge transfer</subject><subject>Chemical bonds</subject><subject>Condensed matter</subject><subject>Distortion</subject><subject>Fermi level</subject><subject>Iron</subject><subject>Mathematical analysis</subject><subject>Scanning tunneling microscopy</subject><subject>Tunneling</subject><issn>1098-0121</issn><issn>1550-235X</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2015</creationdate><recordtype>article</recordtype><recordid>eNo1kMtOwzAQRS0EEqXwA6y8bBcpHj9SZ1kqChGVQAgkdpZjOyQojYPdVMrfEyis5s7VmVkchK6BLAAIu3muhvjiDreLDBaEC87JCZqAECShTLyfjplkMiFA4RxdxPhJCPCM0wkq8nYf9M43zvSNDs2Ag4u-OTiLH31r_e_a6tY47Etc1R9VEru6xRuHZzjP8RwnnQ9dNYSx1Db6UIynvsWrfgQAAM8v0Vmpm-iu_uYUvW3uXtcPyfbpPl-vtomhkuwTwWVpS8GcSNPUOmKktYVgqc2cNCIrxzaTVGtpJeWQMi6hLBjT2ZISzoRhUzQ7_u2C_-pd3KtdHY1rGt0630cFSzJKAMFhROkRNcHHGFypulDvdBgUEPUjVP0LVRmoo1D2DY21aJg</recordid><startdate>20150130</startdate><enddate>20150130</enddate><creator>Wang, Weihua</creator><creator>Pang, Rui</creator><creator>Kuang, Guowen</creator><creator>Shi, Xingqiang</creator><creator>Shang, Xuesong</creator><creator>Liu, Pei Nian</creator><creator>Lin, Nian</creator><scope>AAYXX</scope><scope>CITATION</scope><scope>7U5</scope><scope>8FD</scope><scope>H8D</scope><scope>L7M</scope></search><sort><creationdate>20150130</creationdate><title>Intramolecularly resolved Kondo resonance of high-spin Fe ( II ) -porphyrin adsorbed on Au ( 111 )</title><author>Wang, Weihua ; Pang, Rui ; Kuang, Guowen ; Shi, Xingqiang ; Shang, Xuesong ; Liu, Pei Nian ; Lin, Nian</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c280t-548fdf53e5666de0c8ddb536d9e8c59f666982aa8d824163481fb33a9720435c3</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2015</creationdate><topic>Charge transfer</topic><topic>Chemical bonds</topic><topic>Condensed matter</topic><topic>Distortion</topic><topic>Fermi level</topic><topic>Iron</topic><topic>Mathematical analysis</topic><topic>Scanning tunneling microscopy</topic><topic>Tunneling</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Wang, Weihua</creatorcontrib><creatorcontrib>Pang, Rui</creatorcontrib><creatorcontrib>Kuang, Guowen</creatorcontrib><creatorcontrib>Shi, Xingqiang</creatorcontrib><creatorcontrib>Shang, Xuesong</creatorcontrib><creatorcontrib>Liu, Pei Nian</creatorcontrib><creatorcontrib>Lin, Nian</creatorcontrib><collection>CrossRef</collection><collection>Solid State and Superconductivity Abstracts</collection><collection>Technology Research Database</collection><collection>Aerospace Database</collection><collection>Advanced Technologies Database with Aerospace</collection><jtitle>Physical review. B, Condensed matter and materials physics</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Wang, Weihua</au><au>Pang, Rui</au><au>Kuang, Guowen</au><au>Shi, Xingqiang</au><au>Shang, Xuesong</au><au>Liu, Pei Nian</au><au>Lin, Nian</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Intramolecularly resolved Kondo resonance of high-spin Fe ( II ) -porphyrin adsorbed on Au ( 111 )</atitle><jtitle>Physical review. B, Condensed matter and materials physics</jtitle><date>2015-01-30</date><risdate>2015</risdate><volume>91</volume><issue>4</issue><artnum>045440</artnum><issn>1098-0121</issn><eissn>1550-235X</eissn><abstract>Using cryogenic scanning tunneling microscopy, we measured the electronic states and Kondo resonance of single Fe(II)-porphyrin molecules adsorbed on a Au(111) surface with intramolecular resolution. We found that the Fe(II) ion introduces a spin-polarized molecular state near the Fermi level. Tunneling spectroscopy revealed that this state gives rise to Kondo resonance exhibiting characteristics different from those of the Fe(II) spin state. Spin-polarized density functional theory calculations revealed that the molecule was weakly adsorbed on the surface, yet still switches its spin configuration from S = 1 to 2. The spin switching was found to be driven by three effects: a structural distortion of the macrocyclic ring from planar to saddle shaped, a weak chemical bonding between the Fe and the Au surface atom underneath, and weakened Fe-N bonds due to Au(111)-molecule charge transfer.</abstract><doi>10.1103/PhysRevB.91.045440</doi></addata></record> |
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subjects | Charge transfer Chemical bonds Condensed matter Distortion Fermi level Iron Mathematical analysis Scanning tunneling microscopy Tunneling |
title | Intramolecularly resolved Kondo resonance of high-spin Fe ( II ) -porphyrin adsorbed on Au ( 111 ) |
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