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Showing 21 - 40 results of 42 for search '"tiheysfunktionaaliteoria"', query time: 0.03s Refine Results
  1. 21
    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
    Subjects:
    Linkki verkkoaineistoon
    Doctoral dissertation
  2. 22
    Theoretical investigations of ligand protected silver nanoclusters

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

    Published 2016
    Subjects:
    Doctoral dissertation
  3. 23
    Modeling of borophene with density-functional tight-binding

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

    Published 2020
    Subjects:
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    Master's thesis
  4. 24
    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
    Subjects:
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    Master's thesis
  5. 25
    Uncertainty analysis and symmetry restoration in nuclear self-consistent methods

    Uncertainty analysis and symmetry restoration in nuclear self-consistent methods by Gao, Yuan, kirjoittaja

    Published 2015
    Subjects:
    Yhteenveto-osa
    Doctoral dissertation
  6. 26
    Uncertainty analysis and symmetry restoration in nuclear self-consistent methods

    Uncertainty analysis and symmetry restoration in nuclear self-consistent methods by Gao, Yuan, kirjoittaja

    Published 2015
    Subjects:
    JYX julkaisuarkisto / JYX Digital Archive
    Doctoral dissertation
  7. 27
    Optical properties of metal clusters and cluster arrangements

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

    Published 2020
    Subjects:
    JYX-julkaisuarkisto / JYX Digital Archive
    Linkki verkkoaineistoon
    Doctoral dissertation
  8. 28
    Real-space quantum transport in two-dimensional nanostructures in magnetic fields

    Real-space quantum transport in two-dimensional nanostructures in magnetic fields by Kotimäki, Ville, kirjoittaja

    Published 2013
    Subjects: “…ajasta riippuva tiheysfunktionaaliteoria…”
    Doctoral dissertation
  9. 29
    Real-space quantum transport in two-dimensional nanostructures in magnetic fields

    Real-space quantum transport in two-dimensional nanostructures in magnetic fields by Kotimäki, Ville, kirjoittaja

    Published 2013
    Subjects: “…ajasta riippuva tiheysfunktionaaliteoria…”
    JYX julkaisuarkisto / JYX Digital Archive
    Doctoral dissertation
  10. 30
    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
    Subjects: “…tiheysfunktionaaliteoria…”
    Linkki verkkoaineistoon
    Doctoral dissertation
  11. 31
    Understanding selective reduction reactions with heterogeneous Pd and Pt : climbing out of the black box

    Understanding selective reduction reactions with heterogeneous Pd and Pt : climbing out of the black box by Tuokko, Sakari, kirjoittaja

    Published 2016
    Subjects:
    Doctoral dissertation
  12. 32
    Developments in many-body theory of quantum transport and spectroscopy with non-equilibrium Green's functions and time-dependent density functional theory

    Developments in many-body theory of quantum transport and spectroscopy with non-equilibrium Green's functions and time-dependent density functional theory by Uimonen, Anna-Maija, kirjoittaja

    Published 2015
    Subjects:
    Yhteenveto-osa
    Doctoral dissertation
  13. 33
    Understanding selective reduction reactions with heterogeneous Pd and Pt : climbing out of the black box

    Understanding selective reduction reactions with heterogeneous Pd and Pt : climbing out of the black box by Tuokko, Sakari, kirjoittaja

    Published 2016
    Subjects:
    JYX-julkaisuarkisto / JYX Digital Archive
    Doctoral dissertation
  14. 34
    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
    Subjects:
    JYX-julkaisuarkisto / JYX Digital Archive
    Doctoral dissertation
  15. 35
    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
    Subjects:
    JYX-julkaisuarkisto / JYX Digital Archive
    Linkki verkkoaineistoon
    Doctoral dissertation
  16. 36
    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
    Subjects:
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    Master's thesis
  17. 37
    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
    Subjects:
    Linkki verkkoaineistoon
    Linkki verkkoaineistoon
    Doctoral dissertation
  18. 38
    Density functional/molecular dynamics simulations of phase-change materials

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

    Published 2013
    Subjects:
    JYX julkaisuarkisto / JYX Digital Archive
    Doctoral dissertation
  19. 39
    Density functional/molecular dynamics simulations of phase-change materials

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

    Published 2013
    Subjects:
    Yhteenveto-osa
    Doctoral dissertation
  20. 40
    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
    Subjects:
    Doctoral dissertation
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