4 Publications
2023 | Dissertation | LibreCat-ID: 43829
Badalov S. Modelling Electron Exchange and Correlation for Catalyst Electronic Structure Simulations.; 2023. doi:10.17619/UNIPB/1-1680
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2023 | Journal Article | LibreCat-ID: 43827 |

Meier A, Badalov S, Biktagirov T, Schmidt WG, Wilhelm R. Diquat Based Dyes: A New Class of Photoredox Catalysts and Their Use in Aerobic Thiocyanation. Chemistry – A European Journal. 2023;29(22):e202203541. doi:10.1002/chem.202203541
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2023 | Journal Article | LibreCat-ID: 45764 |

Badalov S, Bocchini A, Wilhelm R, Kozub AL, Gerstmann U, Schmidt WG. Rutile, anatase, brookite and titania thin film from Hubbard corrected and hybrid DFT. Materials Research Express. doi:10.1088/2053-1591/ace0fa
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2020 | Journal Article | LibreCat-ID: 19189 |

Badalov S, Wilhelm R, Schmidt WG. Photocatalytic properties of graphene‐supported titania clusters from density‐functional theory. Journal of Computational Chemistry. Published online 2020:1921-1930. doi:10.1002/jcc.26363
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4 Publications
2023 | Dissertation | LibreCat-ID: 43829
Badalov S. Modelling Electron Exchange and Correlation for Catalyst Electronic Structure Simulations.; 2023. doi:10.17619/UNIPB/1-1680
LibreCat
| DOI
| Download (ext.)
2023 | Journal Article | LibreCat-ID: 43827 |

Meier A, Badalov S, Biktagirov T, Schmidt WG, Wilhelm R. Diquat Based Dyes: A New Class of Photoredox Catalysts and Their Use in Aerobic Thiocyanation. Chemistry – A European Journal. 2023;29(22):e202203541. doi:10.1002/chem.202203541
LibreCat
| Files available
| DOI
| Download (ext.)
2023 | Journal Article | LibreCat-ID: 45764 |

Badalov S, Bocchini A, Wilhelm R, Kozub AL, Gerstmann U, Schmidt WG. Rutile, anatase, brookite and titania thin film from Hubbard corrected and hybrid DFT. Materials Research Express. doi:10.1088/2053-1591/ace0fa
LibreCat
| Files available
| DOI
| Download (ext.)
2020 | Journal Article | LibreCat-ID: 19189 |

Badalov S, Wilhelm R, Schmidt WG. Photocatalytic properties of graphene‐supported titania clusters from density‐functional theory. Journal of Computational Chemistry. Published online 2020:1921-1930. doi:10.1002/jcc.26363
LibreCat
| Files available
| DOI
| Download (ext.)