000807088 001__ 807088
000807088 005__ 20230426083132.0
000807088 0247_ $$2doi$$a10.1103/PhysRevB.93.115123
000807088 0247_ $$2ISSN$$a0163-1829
000807088 0247_ $$2ISSN$$a0556-2805
000807088 0247_ $$2ISSN$$a1095-3795
000807088 0247_ $$2ISSN$$a1098-0121
000807088 0247_ $$2ISSN$$a1550-235X
000807088 0247_ $$2ISSN$$a2469-9969
000807088 0247_ $$2Handle$$a2128/10779
000807088 0247_ $$2WOS$$aWOS:000372407200001
000807088 0247_ $$2altmetric$$aaltmetric:4676488
000807088 037__ $$aFZJ-2016-02116
000807088 041__ $$aEnglish
000807088 082__ $$a530
000807088 1001_ $$0P:(DE-Juel1)157604$$aDang, Hung The$$b0$$eCorresponding author
000807088 245__ $$aStrong correlation effects in theoretical STM studies of magnetic adatoms
000807088 260__ $$aCollege Park, Md.$$bAPS$$c2016
000807088 3367_ $$2DRIVER$$aarticle
000807088 3367_ $$2DataCite$$aOutput Types/Journal article
000807088 3367_ $$0PUB:(DE-HGF)16$$2PUB:(DE-HGF)$$aJournal Article$$bjournal$$mjournal$$s1459760992_5281
000807088 3367_ $$2BibTeX$$aARTICLE
000807088 3367_ $$2ORCID$$aJOURNAL_ARTICLE
000807088 3367_ $$00$$2EndNote$$aJournal Article
000807088 520__ $$aWe present a theoretical study for the scanning tunneling microscopy (STM) spectra of surface-supported magnetic nanostructures, incorporating strong correlation effects. As concrete examples, we study Co and Mn adatoms on the Cu(111) surface, which are expected to represent the opposite limits of Kondo physics and local moment behavior, using a combination of density functional theory and both quantum Monte Carlo and exact diagonalization impurity solvers. We examine in detail the effects of temperature T, correlation strength U, and impurity d electron occupancy Nd on the local density of states. We also study the effective coherence energy scale, i.e., the Kondo temperature TK, which can be extracted from the STM spectra. Theoretical STM spectra are computed as a function of STM tip position relative to each adatom. Because of the multiorbital nature of the adatoms, the STM spectra are shown to consist of a complicated superposition of orbital contributions, with different orbital symmetries, self-energies, and Kondo temperatures. For a Mn adatom, which is close to half-filling, the STM spectra are featureless near the Fermi level. On the other hand, the quasiparticle peak for a Co adatom gives rise to strongly position-dependent Fano line shapes.
000807088 536__ $$0G:(DE-HGF)POF3-142$$a142 - Controlling Spin-Based Phenomena (POF3-142)$$cPOF3-142$$fPOF III$$x0
000807088 542__ $$2Crossref$$i2016-03-14$$uhttp://link.aps.org/licenses/aps-default-license
000807088 588__ $$aDataset connected to CrossRef
000807088 7001_ $$0P:(DE-Juel1)145395$$ados Santos Dias, Manuel$$b1$$ufzj
000807088 7001_ $$0P:(DE-Juel1)130801$$aLiebsch, Ansgar$$b2$$ufzj
000807088 7001_ $$0P:(DE-Juel1)130805$$aLounis, Samir$$b3$$ufzj
000807088 77318 $$2Crossref$$3journal-article$$a10.1103/physrevb.93.115123$$bAmerican Physical Society (APS)$$d2016-03-14$$n11$$p115123$$tPhysical Review B$$v93$$x2469-9950$$y2016
000807088 773__ $$0PERI:(DE-600)2844160-6$$a10.1103/PhysRevB.93.115123$$gVol. 93, no. 11, p. 115123$$n11$$p115123$$tPhysical review / B$$v93$$x2469-9950$$y2016
000807088 8564_ $$uhttps://juser.fz-juelich.de/record/807088/files/PhysRevB.93.115123.pdf$$yOpenAccess
000807088 8564_ $$uhttps://juser.fz-juelich.de/record/807088/files/PhysRevB.93.115123.gif?subformat=icon$$xicon$$yOpenAccess
000807088 8564_ $$uhttps://juser.fz-juelich.de/record/807088/files/PhysRevB.93.115123.jpg?subformat=icon-180$$xicon-180$$yOpenAccess
000807088 8564_ $$uhttps://juser.fz-juelich.de/record/807088/files/PhysRevB.93.115123.jpg?subformat=icon-700$$xicon-700$$yOpenAccess
000807088 8564_ $$uhttps://juser.fz-juelich.de/record/807088/files/PhysRevB.93.115123.pdf?subformat=pdfa$$xpdfa$$yOpenAccess
000807088 909CO $$ooai:juser.fz-juelich.de:807088$$pdnbdelivery$$pVDB$$pdriver$$popen_access$$popenaire
000807088 9101_ $$0I:(DE-588b)5008462-8$$6P:(DE-Juel1)145395$$aForschungszentrum Jülich GmbH$$b1$$kFZJ
000807088 9101_ $$0I:(DE-588b)5008462-8$$6P:(DE-Juel1)130801$$aForschungszentrum Jülich GmbH$$b2$$kFZJ
000807088 9101_ $$0I:(DE-588b)5008462-8$$6P:(DE-Juel1)130805$$aForschungszentrum Jülich GmbH$$b3$$kFZJ
000807088 9131_ $$0G:(DE-HGF)POF3-142$$1G:(DE-HGF)POF3-140$$2G:(DE-HGF)POF3-100$$3G:(DE-HGF)POF3$$4G:(DE-HGF)POF$$aDE-HGF$$bEnergie$$lFuture Information Technology - Fundamentals, Novel Concepts and Energy Efficiency (FIT)$$vControlling Spin-Based Phenomena$$x0
000807088 9141_ $$y2016
000807088 915__ $$0StatID:(DE-HGF)0150$$2StatID$$aDBCoverage$$bWeb of Science Core Collection
000807088 915__ $$0LIC:(DE-HGF)APS-112012$$2HGFVOC$$aAmerican Physical Society Transfer of Copyright Agreement
000807088 915__ $$0StatID:(DE-HGF)1150$$2StatID$$aDBCoverage$$bCurrent Contents - Physical, Chemical and Earth Sciences
000807088 915__ $$0StatID:(DE-HGF)0200$$2StatID$$aDBCoverage$$bSCOPUS
000807088 915__ $$0StatID:(DE-HGF)0110$$2StatID$$aWoS$$bScience Citation Index
000807088 915__ $$0StatID:(DE-HGF)0111$$2StatID$$aWoS$$bScience Citation Index Expanded
000807088 915__ $$0StatID:(DE-HGF)9900$$2StatID$$aIF < 5
000807088 915__ $$0StatID:(DE-HGF)0510$$2StatID$$aOpenAccess
000807088 915__ $$0StatID:(DE-HGF)0100$$2StatID$$aJCR$$bPHYS REV B : 2014
000807088 915__ $$0StatID:(DE-HGF)0300$$2StatID$$aDBCoverage$$bMedline
000807088 915__ $$0StatID:(DE-HGF)0420$$2StatID$$aNationallizenz
000807088 915__ $$0StatID:(DE-HGF)0199$$2StatID$$aDBCoverage$$bThomson Reuters Master Journal List
000807088 9201_ $$0I:(DE-Juel1)IAS-1-20090406$$kIAS-1$$lQuanten-Theorie der Materialien$$x0
000807088 9201_ $$0I:(DE-Juel1)PGI-1-20110106$$kPGI-1$$lQuanten-Theorie der Materialien$$x1
000807088 9201_ $$0I:(DE-82)080009_20140620$$kJARA-FIT$$lJARA-FIT$$x2
000807088 9201_ $$0I:(DE-82)080012_20140620$$kJARA-HPC$$lJARA - HPC$$x3
000807088 9801_ $$aUNRESTRICTED
000807088 9801_ $$aFullTexts
000807088 980__ $$ajournal
000807088 980__ $$aVDB
000807088 980__ $$aUNRESTRICTED
000807088 980__ $$aI:(DE-Juel1)IAS-1-20090406
000807088 980__ $$aI:(DE-Juel1)PGI-1-20110106
000807088 980__ $$aI:(DE-82)080009_20140620
000807088 980__ $$aI:(DE-82)080012_20140620
000807088 981__ $$aI:(DE-Juel1)PGI-1-20110106
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/RevModPhys.81.1495
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1088/0953-8984/17/13/003
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1126/science.1101077
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1126/science.1146110
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.106.037205
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.111.157204
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.80.2893
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1126/science.280.5363.567
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.88.096804
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.88.077205
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1038/nphys1072
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1088/0953-8984/21/5/053001
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1038/nphys1876
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.108.166604
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1038/ncomms6417
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.114.076601
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1088/1367-2630/17/6/063016
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1126/science.1214131
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1126/science.1252841
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.84.212401
000807088 999C5 $$1A. C. Hewson$$2Crossref$$oA. C. Hewson The Kondo Problem to Heavy Fermions 1997$$tThe Kondo Problem to Heavy Fermions$$y1997
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.86.4132
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.86.235415
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1021/nl0804203
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.103.016803
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.85.085114
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.108.206807
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.110.186404
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1088/0953-8984/27/24/245606
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.85.2557
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.63.085404
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.89.235439
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.92.235127
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.92.045119
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1088/0953-8984/14/11/304
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.97.076405
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/RevModPhys.83.349
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.72.1545
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1088/0953-8984/24/5/053201
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1038/35000508
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.50.1998
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1139/p80-159
000807088 999C5 $$1J. Slater$$2Crossref$$oJ. Slater Quantum Theory of Atomic Structure. 1 (1960) 1960$$tQuantum Theory of Atomic Structure. 1 (1960)$$y1960
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1016/j.cpc.2015.04.023
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1016/j.cpc.2015.10.023
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.44.943
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.49.14211
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1134/S1063776113030126
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.86.195136
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.90.125114
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.90.075136
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1016/0370-1573(95)00074-7
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1143/JPSJ.74.8
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.94.036805
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.73.195421
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.112.177001
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.106.096401
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevLett.103.147205
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/RevModPhys.70.1039
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1146/annurev-conmatphys-020911-125045
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1038/nnano.2015.193
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.90.235103
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.81.054513
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.82.155106
000807088 999C5 $$2Crossref$$9-- missing cx lookup --$$a10.1103/PhysRevB.86.205115