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1

Journal Article

Semiempirical van der Waals interactions versus ab initio nonlocal correlation effects in the thiophene-Cu(111) system

Callsen, M.
2012

Physical Review B Physical review / B, 86 86 (2012 2012) 8 8, S. 085439 085439

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2

Journal Article

Arylthio-substituted coronenes as tailored building blocks for molecular electronics

Kowalzik, P.
2012

Physical Chemistry Chemical Physics, 14 (2012) S. 1635 - 1641

Get full text Published under German "Allianz" Licensing conditions on 2011-11-28. Available in OpenAccess from 2012-11-28

3

Journal Article

Rationale for switching to nonlocal functionals in density functional theory

Lazic, P.
2012

Journal of physics / Condensed matter, 24 (2012) S. 424215

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4

Journal Article

Tuning the electron transport of molecular junctions by chemically functionalizing anchoring groups: First-principles study

Tsukamoto, S.
2012

Physical Review B Physical review / B, 85 85 (2012 2012) 24 24, S. 245435 245435

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5

Journal Article

Graphene on Ir(111): Physisorption with Chemical Modulation

Busse, C.
2011

Physical review letters, 107 (2011) S. 036101

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6

Journal Article

Engineering the magnetic properties of hybrid organic-ferromagnetic interfaces by molecular chemical functionalization

Atodiresei, N.
2011

Physical Review B Physical review / B, 84 84 (2011 2011) 17 17, S. 172402 172402

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7

Journal Article

Density functional theory with nonlocal correlation: A key to the solution of the CO adsorption puzzle

Lazic, P.
2010

Physical Review B Physical review / B, 81 81 (2010 2010) 4 4, S. 045401 045401

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8

Journal Article

Design of the Local Spin Polarization at the Organic-Ferromagnetic Interface

Atodiresei, N.
2010

Physical review letters, 105 (2010) S. 066601

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9

Journal Article

Electronic Mapping of Molecular Orbitals at the Molecule-Metal Interface

Lennartz, M.C.
2010

Physical review letters, 105 (2010) S. 066801

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10

Journal Article

Spin- and Energy-Dependent Tunneling through a Single Molecule with Intramolecular Spatial Resolution

Brede, J.
2010

Physical review letters, 105 (2010) S. 047204

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11

Journal Article

Chemical versus van der Waals Interaction: The Role of the Heteroatom in the Flat Absorption of Aromatic Molecules C6H6, C5NH5, and C4N2H4 on the Cu(110) Surface

Atodiresei, N.
2009

Physical review letters, 102 (2009) S. 136809

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12

Journal Article

Role of the van der Waals interactions on the bonding mechanism of pyridine on Cu(110) and Ag(110) surfaces: A first-principles study

Atodiresei, N.
2008

Physical Review B Physical review / B, 78 78 (2008 2008) 4 4, S. 045411 045411

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13

Journal Article

Manipulation of benzene on Cu(110) by dynamic force microscopy: An ab-initio study

Atodiresei, N.
2008

Physical Review B Physical review / B, 77 77 (2008 2008) 15 15, S. 153408 153408

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14

Journal Article

Role of tip size, orientation, and structural relaxations in first principles studies of magnetic exchange force microscopy and spin polarized scanning tunneling microscopy

Lazo, C.
2008

Physical Review B Physical review / B, 78 78 (2008 2008) 21 21, S. 214416 214416

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