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Yu, Ping ; Kocić, Nemanja ; Repp, Jascha ; Siegert, Benjamin ; Donarini, Andrea

Apparent Reversal of Molecular Orbitals Reveals Entanglement

Article

Yu, Ping , Kocić, Nemanja, Repp, Jascha , Siegert, Benjamin and Donarini, Andrea (2017) Apparent Reversal of Molecular Orbitals Reveals Entanglement. Physical Review Letters 119 (5), 056801.

DOI to cite this document: 10.5283/epub.36073


Abstract

The frontier orbital sequence of individual dicyanovinyl-substituted oligothiophene molecules is studied by means of scanning tunneling microscopy. On NaCl/Cud(111), the molecules are neutral, and the two lowest unoccupied molecular states are observed in the expected order of increasing energy. On NaCl/Cud(311), where the molecules are negatively charged, the sequence of two observed molecular ...

The frontier orbital sequence of individual dicyanovinyl-substituted oligothiophene molecules is studied by means of scanning tunneling microscopy. On NaCl/Cud(111), the molecules are neutral, and the two lowest unoccupied molecular states are observed in the expected order of increasing energy. On NaCl/Cud(311), where the molecules are negatively charged, the sequence of two observed molecular orbitals is reversed, such that the one with one more nodal plane appears lower in energy. These experimental results, in open contradiction with a single-particle interpretation, are explained by a manybody theory predicting a strongly entangled doubly charged ground state.



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Details

Item typeArticle
Journal or Publication TitlePhysical Review Letters
PublisherAMER PHYSICAL SOC
Open Access TypeDue to SHERPA/RoMEO
Place of PublicationCOLLEGE PK
Volume119
Number of Issue or Book Chapter5
Page Range056801
Date1 August 2017
Date of publication08 Aug 2017 05:56
InstitutionsPhysics > Institute of Theroretical Physics > Chair Professor Grifoni > Group Milena Grifoni
Physics > Institute of Theroretical Physics > Chair Professor Grifoni > Group John Schliemann
Physics > Institute of Theroretical Physics > Chair Ferdinand Evers
Physics > Institute of Theroretical Physics > Chair Professor Grifoni > Group David Egger
Physics > Institute of Experimental and Applied Physics > Group Jascha Repp
Identification Number
ValueType
10.1103/PhysRevLett.119.056801DOI
KeywordsATOMIC-FORCE MICROSCOPY; PI-CONJUGATED MOLECULES; SINGLE-MOLECULE; ELECTRONIC-STRUCTURE; WORK FUNCTION; CHARGE-STATE; OLIGOTHIOPHENE; INTERFERENCE; CONDUCTANCE; WIRES;
Dewey Decimal Classification500 Science > 530 Physics
StatusPublished
RefereedYes, this version has been refereed
Created at the University of RegensburgYes
URN of the UB Regensburgurn:nbn:de:bvb:355-epub-360739
Item ID36073

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