publication_list

2007

Journal Article

Cavalleri, Matteo, Klaus Hermann, Sébastien Guimond, Yuriy Romanyshyn, Helmut Kuhlenbeck and Hans-Joachim Freund: X-ray spectroscopic fingerprints of reactive oxygen sites at the MoO₃(0 1 0) surface.

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Journal Article

Kolczewski, Christine, Klaus Hermann, Sébastien Guimond, Helmut Kuhlenbeck and Hans-Joachim Freund: Identification of the vanadyl terminated V₂O₃(0 0 0 1) surface by NEXAFS spectroscopy: A combined theoretical and experimental study.

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2006

Journal Article

Kolczewski, Christine, R. Püttner, M. Martins, A.S. Schlachter, G. Snell, M.M. Sant'Anna, Klaus Hermann and G. Kaindl: Spectroscopic analysis of small organic molecules: A comprehensive near-edge x-ray-absorption fine-structure study of C₆-ring-containing molecules.

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Journal Article

Kolczewski, Christine, F.J. Williams, R.L. Cropley, O.P.H. Vaughan, A.J. Urquhart, M.S. Tikhov, R.M. Lambert and Klaus Hermann: Adsorption geometry and core excitation spectra of three phenylpropene isomers on Cu(111).

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2005

Journal Article

Bagus, Paul S., Klaus Hermann and Christof Wöll: The interaction of C₆H₆ and C₆H₁₂ with noble metal surfaces: Electronic level alignment and the origin of the interface dipole.

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Journal Article

Kolczewski, Christine and Klaus Hermann: Ab initio DFT studies of oxygen K edge NEXAFS spectra for the V₂O₃(0001) surface.

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Journal Article

Kolczewski, Christine and Klaus Hermann: Oxygen 1s NEXAFS spectra of the V₂O₅(010) surface theoretical studies using ab initio DFT cluster models.

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Journal Article

Williams, Federico J., Rachel L. Cropley, Owain P.H. Vaughan, Andrew J. Urquhart, Mintcho S. Tikhov, Christine Kolczewski, Klaus Hermann and Richard M. Lambert: Critical influence of adsorption geometry in the heterogeneous epoxidation of "allylic" alkenes: Structure and reactivity of three phenylpropene isomers on Cu(111).

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2004

Journal Article

Kolczewski, Christine and Klaus Hermann: Ab initio DFT cluster studies of angle-resolved NEXAFS spectra for differently coordinated oxygen at the V₂O₅(0 1 0) surface.

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Journal Article

Püttner, R., Christine Kolczewski, M. Martins, A.S. Schlachter, György Snell, M. Sant'Anna, Jens Viefhaus, Klaus Hermann and Günter Kaindl: The C 1s NEXAFS spectrum of benzene below threshold: Rydberg or valence character of the unoccupied sigma-type orbitals.

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Journal Article

Tokarz-Sobieraj, Renata, Robert Grybos, Malgorzata Witko and Klaus Hermann: Oxygen sites at molybdena and vanadia surfaces: Energetics of the re-oxidation process.

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2003

Journal Article

Czekaj, Izabela, Klaus Hermann and Malgorzata Witko: Ab initio density functional theory studies on oxygen stabilization at the V₂O₃(0001) surface.

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Journal Article

Czekaj, Izabela, Klaus Hermann and Malgorzata Witko: Relaxation and electronic structure of the V₂O₃(0 0 0 1) surface: ab initio cluster model studies.

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Journal Article

Czekaj, Izabela, Malgorzata Witko and Klaus Hermann: Structure and electronic properties of the V₂O₃(0001) surface: ab initio density functional theory cluster studies.

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Journal Article

Czekaj, Izabela, Malgorzata Witko and Klaus Hermann: Oxygen adsorption at the V₂O₃(0001) surface: DFT cluster model studies.

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Journal Article

Kolczewski, Christine and Klaus Hermann: Identification of oxygen sites at the V₂O₅(010) surface by core-level electron spectroscopy: ab initio cluster studies.

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DOI

2002

Journal Article

Van Hove, Michel A., Klaus Hermann and P.R. Watson: The NIST surface structure database - SSD version 4.

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2001

Journal Article

Haras, A., Malgorzata Witko, D.R. Salahub, Klaus Hermann and Renata Tokarz: Electronic properties of the VO_2(011) surface: density functional cluster calculations.

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Journal Article

Hermann, Klaus, Aparna Chakrabarti, A. Haras, Malgorzata Witko and Bettina Tepper: Electronic Structure of Vanadium Dioxide: Ab initio Density Functional Theory Studies of Periodic and Local Systems.

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Journal Article

Hermann, Klaus, Malgorzata Witko, Rok Druzinic and R. Tokarz: Oxygen vacancies at oxide surfaces: ab initio density functional theory studies on vanadium pentoxide.

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Publications of Klaus Hermann

Journal Article (108)