JuLib | Articles & more - {"Caciuc, V."}

Spin-filters based on single organic molecules designed by ab initio calculations

Atodiresei, N.
2010

“...Caciuc, V....”

62

Graphene on Ir(111) surface: interplay between chemical bonding and van der Waals

Lazic, P.
2010

“...Caciuc, V....”

63

Ab initio design of spin-filters using single organic molecules

Atodiresei, N.
2010

“...Caciuc, V....”

64

Contribution to a book
Contribution to a conference proceedings

JuNoLo – Jülich nonlocal code for parallel post-processing evaluation of vdW-DF correlation energy

Lazic, P.
2010

Computer physics communications, 181 (2010) S. 371 - 379

“...Caciuc, V....”

65

Van der Waals Interaction of Molecules on Surfaces from First Principles

Lazic, P.
2010

“...Caciuc, V....”

66

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

“...Caciuc, V....”
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67

Structural and electron transport investigations of arylthiosubstituted coronene monolayers

Kowalzik, P.
2010

“...Caciuc, V....”

68

Contribution to a book
Contribution to a conference proceedings

Fine tuning of the electronic structure of p-conjugated molecules for molecular electronics

Lennartz, M.C.
2010

“...Caciuc, V....”

69

Graphene on Ir(111): A weakly bonded system

Busse, C.
2010

“...Caciuc, V....”

70

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

“...Caciuc, V....”
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71

Electronic mapping of molecular orbitals at the molecule-metal interface

Lennartz, M.C.
2009

“...Caciuc, V....”

72

Solution of the CO puzzle problem

Lazic, P.
2009

“...Caciuc, V....”

73

The nonlocal correlation as the solution of the Co puzzle problem

Lazic, P.
2009

“...Caciuc, V....”

74

First-principles and semi-empirical van der Waals studies of pyridine and thymine on the Cu(110) surface

Caciuc, V.
2009

75

Chemical versus van der Waals Interaction: The Role of the Heteroatom

Atodiresei, N.
2009

“...Caciuc, V....”

76

Manipulation and Imaging of Aromatic Organic Molecules with Atomically Sharp Tips: The Last Atom Matters

Atodiresei, N.
2008

“...Caciuc, V....”

77

Manipulation of Benzene on Cu(110) by Atomic Force Microscopy: The Last Atom Matters

Atodiresei, N.
2008

“...Caciuc, V....”

78

Ab initio modeling of noncontact atomic force microscopy imaging of benzene on Cu(110) surface

Atodiresei, N.
2008

International Journal of Quantum Chemistry, 108 (2008) S. 2803 - 2812

“...Caciuc, V....”

79

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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