Development of the cyclic cluster approach for ionic systems. - Thomas Bredow; Gerald Geudtner; Karl Jug (J. Comput. Chem., 2001)

MSINDO parameterization for third-row transition metals. - Thomas Bredow; Gerald Geudtner; Karl Jug (J. Comput. Chem., 2001)

Models for the treatment of crystalline solids and surfaces. - Karl Jug; Thomas Bredow (J. Comput. Chem., 2004)

Molecular dynamics implementation in MSINDO: Study of silicon clusters. - Nisanth N. Nair; Thomas Bredow; Karl Jug (J. Comput. Chem., 2004)

Boron-doped diamond: Investigation of the stability of surface-doping versus bulk-doping using cyclic cluster model calculations. - Florian Janetzko; Thomas Bredow; Gerald Geudtner; Andreas M. Köster (J. Comput. Chem., 2008)

MSINDO study of acid promoted dissolution of planar MgO and NiO surfaces. - Darren J. Simpson; Thomas Bredow; Andrea R. Gerson (J. Comput. Chem., 2009)

Assessment of quantum-chemical methods for electronic properties and geometry of signaling biomolecules. - Noel Ferro; Thomas Bredow (J. Comput. Chem., 2010)

The effect of iron and copper impurities on the wettability of sphalerite (110) surface. - Darren J. Simpson; Thomas Bredow; Anand P. Chandra; Giuseppe P. Cavallaro; Andrea R. Gerson (J. Comput. Chem., 2011)

Implementation of empirical dispersion corrections to density functional theory for periodic systems. - Werner Reckien; Florian Janetzko; Michael F. Peintinger; Thomas Bredow (J. Comput. Chem., 2012)

Electronic structure and thermodynamics of V2O3 polymorphs. - Claudia Wessel; Christoph Reimann; Alexander Müller; Dominik Weber; Martin Lerch; Thorsten Ressler; Thomas Bredow; Richard Dronskowski (J. Comput. Chem., 2012)

Consistent gaussian basis sets of Triple-Zeta valence with polarization quality for solid-State Calculations. - Michael F. Peintinger; Daniel Vilela Oliveira; Thomas Bredow (J. Comput. Chem., 2013)

Conductor-like screening model for relaxed excited states: Implementation in the semiempirical method MSINDO. - Katharina Krause; Thomas Bredow (J. Comput. Chem., 2014)

The cyclic cluster model at hartree-fock level. - Michael F. Peintinger; Thomas Bredow (J. Comput. Chem., 2014)

Structure and stability of supramolecular crown ether complexes. - Kim Julia Hintze; Arne Lützen; Thomas Bredow (J. Comput. Chem., 2015)

Adsorption-induced changes of intramolecular optical transitions: PTCDA/NaCl and PTCDA/KCl. - Manuel Hochheim; Thomas Bredow (J. Comput. Chem., 2015)

BonnMag: Computer program for ligand-field analysis of f n systems within the angular overlap model. - Anna Bronova; Thomas Bredow; Robert Glaum; Mark J. Riley; Werner Urland (J. Comput. Chem., 2018)

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 (J. Comput. Chem., 2018)

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 (J. Comput. Chem., 2019)

Critical Assessment of the DFT + U Approach for the Prediction of Vanadium Dioxide Properties. - Berenike Stahl; Thomas Bredow (J. Comput. Chem., 2020)

BSSE-corrected consistent Gaussian basis sets of triple-zeta valence with polarization quality of the sixth period for solid-state calculations. - Joachim Laun; Thomas Bredow (J. Comput. Chem., 2021)

BSSE-corrected consistent Gaussian basis sets of triple-zeta valence with polarization quality of the fifth period for solid-state calculations. - Joachim Laun; Thomas Bredow (J. Comput. Chem., 2022)

BSSE-corrected consistent Gaussian basis sets of triple-zeta valence quality of the lanthanides La-Lu for solid-state calculations. - Leopold Maximilian Seidler; Joachim Laun; Thomas Bredow (J. Comput. Chem., 2023)

Extended benchmark set for lattice parameters of inorganic solids. - Elodie Fernandes Lima; Thomas Bredow (J. Comput. Chem., 2024)