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Thomas Bredow

Thomas Bredow

D-Index & Metrics

Chemistry

D-Index
61
Citations
13579
World Ranking
9221
National Ranking
660

Overview

Thomas Bredow is affiliated with the University of Bonn in Germany. Their research focuses primarily on Materials Science, with notable contributions in Materials Chemistry, Electronic, Optical and Magnetic Materials, and Renewable Energy, Sustainability and the Environment. They have also published work related to Electrical and Electronic Engineering and Inorganic Chemistry.

Their key research topics encompass a range of subjects, including:

  • Crystallization and Solubility Studies
  • X-ray Diffraction in Crystallography
  • Advanced Chemical Physics Studies
  • Inorganic Chemistry and Materials
  • Crystal Structures and Properties
  • Inorganic Fluorides and Related Compounds
  • Advanced Photocatalysis Techniques

Thomas Bredow has been frequently published in several scientific journals. The venues with the highest number of their publications are:

  • The Cambridge Structural Database
  • The Journal of Physical Chemistry C
  • Zeitschrift für Naturforschung B
  • Journal of Computational Chemistry
  • Inorganic Chemistry

Recent papers reflect the focus on computational chemistry and materials science, featuring the following works:

  • "BSSE-corrected consistent Gaussian basis sets of triple-zeta valence with polarization quality of the fifth period for solid-state calculations," 2022, Journal of Computational Chemistry
  • "BSSE-corrected consistent Gaussian basis sets of triple-zeta valence with polarization quality of the sixth period for solid-state calculations," 2021, Journal of Computational Chemistry
  • "GW-BSE Calculations of Electronic Band Gap and Optical Spectrum of ZnFe2O4: Effect of Cation Distribution and Spin Configuration," 2020, ChemPhysChem
  • "Factors Governing the Activity of α-MnO2 Catalysts in the Oxygen Evolution Reaction: Conductivity versus Exposed Surface Area of Cryptomelane," 2020, Chemistry - A European Journal
  • "Photocatalytic H2 production and degradation of aqueous 2-chlorophenol over B/N-graphene-coated Cu0/TiO2: A DFT, experimental and mechanistic investigation," 2022, Journal of Environmental Management

The scientist collaborates frequently with various researchers including Martin Lerch, Eva M. Heppke, Sylvia Lorraine Kunz, Robert Glaum, and Ina Remy-Speckmann, with collaboration counts ranging from 9 to 18 publications.

Best Publications

  • Consistent Gaussian basis sets of triple-zeta valence with polarization quality for solid-state calculations.

    Michael F. Peintinger;Daniel Vilela Oliveira;Thomas Bredow

  • Geometries of Third-Row Transition-Metal Complexes from Density-Functional Theory.

    Michael Bühl;Christoph Reimann;Dimitrios A. Pantazis;Thomas Bredow

  • System-dependent dispersion coefficients for the DFT-D3 treatment of adsorption processes on ionic surfaces.

    Stephan Ehrlich;Jonas Moellmann;Werner Reckien;Thomas Bredow

  • BSSE-correction scheme for consistent gaussian basis sets of double- and triple-zeta valence with polarization quality for solid-state calculations.

    Daniel Vilela Oliveira;Joachim Laun;Michael F. Peintinger;Thomas Bredow

  • Effect of exchange and correlation on bulk properties of MgO, NiO, and CoO

    Thomas Bredow;Andrea R. Gerson

  • Atomically controlled electrochemical nucleation at superionic solid electrolyte surfaces

    Ilia Valov;Ina Sapezanskaia;Alpana Nayak;Tohru Tsuruoka

  • Theoretical investigation of water adsorption at rutile and anatase surfaces

    Thomas Bredow;Karl Jug

  • Organometallic benzene-vanadium wire: A one-dimensional half-metallic ferromagnet.

    Volodymyr V. Maslyuk;Alexei Bagrets;Velimir Meded;Andreas Arnold

  • Consistent gaussian basis sets of double- and triple-zeta valence with polarization quality of the fifth period for solid-state calculations.

    Joachim Laun;Daniel Vilela Oliveira;Thomas Bredow

  • Electronic properties of rutile Ti O 2 ultrathin films: Odd-even oscillations with the number of layers

    Thomas Bredow;Livia Giordano;Fabrizio Cinquini;Gianfranco Pacchioni

  • Theoretical Study of Li Migration in Lithium–Graphite Intercalation Compounds with Dispersion-Corrected DFT Methods

    Sascha Thinius;Mazharul M. Islam;Paul Heitjans;Thomas Bredow

  • Implementation of Empirical Dispersion Corrections to Density Functional Theory for Periodic Systems

    Werner Reckien;Florian Janetzko;Michael F. Peintinger;Thomas Bredow

  • Theory and range of modern semiempirical molecular orbital methods

    Thomas Bredow;Karl Jug

  • Geometrical correction for the inter- and intramolecular basis set superposition error in periodic density functional theory calculations.

    Jan Gerit Brandenburg;Maristella Alessio;Bartolomeo Civalleri;Michael F. Peintinger

  • Cu, Ag, and Au atoms adsorbed on TiO2(110) : cluster and periodic calculations

    Livia Giordano;Gianfranco Pacchioni;Thomas Bredow;Javier Fernández Sanz

  • Electronic structure of an isolated oxygen vacancy at the TiO2(110) surface

    Thomas Bredow;Gianfranco Pacchioni

  • Photoelectrochemical and theoretical investigations of spinel type ferrites (MxFe3-xO4) for water splitting: A mini-review

    Dereje H. Taffa;Ralf Dillert;Anna C. Ulpe;Katharina C. L. Bauerfeind

  • Binding energy of adsorbates on a noble-metal surface: Exchange and correlation effects

    Michael Rohlfing;Thomas Bredow

  • Effect of the degree of inversion on optical properties of spinel ZnFe2O4

    Luis I. Granone;Anna C. Ulpe;Lars Robben;Stephen Klimke

  • Electronic properties of oxygen-deficient and aluminum-doped rutile Ti O 2 from first principles

    Mazharul M. Islam;Thomas Bredow;Andrea Gerson

  • ATR-FTIR measurements and quantum chemical calculations concerning the adsorption and photoreaction of oxalic acid on TiO2.

    Cecilia B. Mendive;Thomas Bredow;Miguel A. Blesa;Detlef W. Bahnemann

Frequent Co-Authors

Karl Jug
Karl Jug University of Hannover
Paul Heitjans
Paul Heitjans University of Hannover
Detlef W. Bahnemann
Detlef W. Bahnemann Saint Petersburg State University
Richard Dronskowski
Richard Dronskowski RWTH Aachen University
Martin Wilkening
Martin Wilkening Graz University of Technology
Sylvio Indris
Sylvio Indris Karlsruhe Institute of Technology
Michael Wark
Michael Wark Carl von Ossietzky University of Oldenburg
Christian Minot
Christian Minot Sorbonne University
Moritz Sokolowski
Moritz Sokolowski University of Bonn
Gianfranco Pacchioni
Gianfranco Pacchioni University of Milano-Bicocca

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