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  1. 1
    Computational modelling of carbon dioxide reduction to methanol on heterogeneous zirconia-supported copper catalysts

    Computational modelling of carbon dioxide reduction to methanol on heterogeneous zirconia-supported copper catalysts by Lempelto, Aku, kirjoittaja

    Published 2024
    Linkki verkkoaineistoon
    Doctoral dissertation
  2. 2
    Multiscale computational investigation of catalytic properties of zirconia supported noble metals

    Multiscale computational investigation of catalytic properties of zirconia supported noble metals by Kauppinen, Minttu, kirjoittaja

    Published 2020
    JYX-julkaisuarkisto / JYX Digital Archive
    Linkki verkkoaineistoon
    Doctoral dissertation
  3. 3
    Optical properties of metal clusters and cluster arrangements

    Optical properties of metal clusters and cluster arrangements by Selenius, Elli, kirjoittaja

    Published 2020
    JYX-julkaisuarkisto / JYX Digital Archive
    Linkki verkkoaineistoon
    Doctoral dissertation
  4. 4
    Analysis and applications of electronic structure in gold and silver nanoclusters

    Analysis and applications of electronic structure in gold and silver nanoclusters by Kaappa, Sami, kirjoittaja

    Published 2019
    JYX-julkaisuarkisto / JYX Digital Archive
    Doctoral dissertation
  5. 5
    Electronic and optical properties of gold clusters with carbene ligands using density functional theory calculations

    Electronic and optical properties of gold clusters with carbene ligands using density functional theory calculations by Sabooni Asre Hazer, Maryam, kirjoittaja

    Published 2023
    Linkki verkkoaineistoon
    Linkki verkkoaineistoon
    Doctoral dissertation
  6. 6
    Computational studies of catalytic active site properties and reactions at the metal–oxide interface

    Computational studies of catalytic active site properties and reactions at the metal–oxide interface by Korpelin, Ville, kirjoittaja

    Published 2022
    Linkki verkkoaineistoon
    Doctoral dissertation
  7. 7
    Density functional/molecular dynamics simulations of phase-change materials

    Density functional/molecular dynamics simulations of phase-change materials by Kalikka, Janne

    Published 2013
    JYX julkaisuarkisto / JYX Digital Archive
    Doctoral dissertation
  8. 8
    Density functional/molecular dynamics simulations of phase-change materials

    Density functional/molecular dynamics simulations of phase-change materials by Kalikka, Janne

    Published 2013
    Yhteenveto-osa
    Doctoral dissertation
  9. 9
    Theoretical investigations of ligand protected silver nanoclusters

    Theoretical investigations of ligand protected silver nanoclusters by Gell, Lars, kirjoittaja

    Published 2016
    Doctoral dissertation
  10. 10
    N-monoalkylated DABCO-based N-donors as versatile building blocks in crystal engineering and supramolecular chemistry

    N-monoalkylated DABCO-based N-donors as versatile building blocks in crystal engineering and supramolecular chemistry by Peuronen, Anssi, kirjoittaja

    Published 2014
    Doctoral dissertation
  11. 11
    Modeling of borophene with density-functional tight-binding

    Modeling of borophene with density-functional tight-binding by Ukkola, Eerik

    Published 2020
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    Master's thesis
  12. 12
    Predicting exchange coupling in molecular systems with Density Functional Theory

    Predicting exchange coupling in molecular systems with Density Functional Theory by Toivola, Juho

    Published 2021
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    Master's thesis
  13. 13
    Exploring the chemistry of syngas on a m-ZrO2 surface with computational methods

    Exploring the chemistry of syngas on a m-ZrO2 surface with computational methods by Ikonen, Rasmus

    Published 2023
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    Master's thesis
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