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  1. 21
    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
  2. 22
    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
  3. 23
    Development of nuclear energy density functionals from optimization to uncertainty analysis

    Development of nuclear energy density functionals from optimization to uncertainty analysis by Haverinen, Tiia, kirjoittaja

    Published 2020
    JYX-julkaisuarkisto / JYX Digital Archive
    Linkki verkkoaineistoon
    Doctoral dissertation
  4. 24
    Theoretical and computational studies of magnetic anisotropy and exchange coupling in molecular systems

    Theoretical and computational studies of magnetic anisotropy and exchange coupling in molecular systems by Mansikkamäki, Akseli, 1987- kirjoittaja

    Published 2018
    JYX-julkaisuarkisto / JYX Digital Archive
    Doctoral dissertation
  5. 25
    Model nuclear energy density functionals derived from ab initio calculations

    Model nuclear energy density functionals derived from ab initio calculations by Salvioni, Gianluca, kirjoittaja

    Published 2019
    JYX-julkaisuarkisto / JYX Digital Archive
    Doctoral dissertation
  6. 26
    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
  7. 27
    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
  8. 28
    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
  9. 29
    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
  10. 30
    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
    Yhteenveto-osa
    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
    Doctoral dissertation
  12. 32
    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. 33
    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
  14. 34
    Metanolisynteesin laskennallinen tutkimus Cu/ZnO-katalyyteillä

    Metanolisynteesin laskennallinen tutkimus Cu/ZnO-katalyyteillä by Salmela, Matti

    Published 2021
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    Master's thesis
  15. 35
    Vesikaasureaktion mallintaminen laskennallisin menetelmin kupari- ja nikkelipinnoilla

    Vesikaasureaktion mallintaminen laskennallisin menetelmin kupari- ja nikkelipinnoilla by Salmela, Matti

    Published 2020
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    Bachelor's thesis
  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
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    Master's thesis
  17. 37
    Formiaattimolekyylin dissosiaation määritys platina- ja rhodiumpinnoilla laskennallisesti

    Formiaattimolekyylin dissosiaation määritys platina- ja rhodiumpinnoilla laskennallisesti by Sääksvuori, Juuso

    Published 2017
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    Master's thesis
  18. 38
    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
    JYX-julkaisuarkisto / JYX Digital Archive
    Doctoral dissertation
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