Search Results - Berski, Slawomir

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  1. 1
    Exploring the Relationship between Reactivity and Electronic Structure in Isorhodanine Derivatives Using Computer Simulations

    Exploring the Relationship between Reactivity and Electronic Structure in Isorhodanine Derivatives Using Computer Simulations by Michalski, Michal, Berski, Slawomir

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  2. 2
    The nature of multiple boron-nitrogen bonds studied using electron localization function (ELF), electron density (AIM), and natural bond orbital (NBO) methods

    The nature of multiple boron-nitrogen bonds studied using electron localization function (ELF), electron density (AIM), and natural bond orbital (NBO) methods by Mierzwa, Grzegorz, Gordon, Agnieszka J., Berski, Slawomir

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  3. 3
    Understanding Reaction Mechanisms in Organic Chemistry from Catastrophe Theory Applied to the Electron Localization Function Topology

    Understanding Reaction Mechanisms in Organic Chemistry from Catastrophe Theory Applied to the Electron Localization Function Topology by Polo, Victor, Andres, Juan, Berski, Slawomir, Domingo, Luis R, Silvi, Bernard

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  4. 4
    The nature of the T=T double bond (T = B, Al, Ga, In) in dialumene and its derivatives: topological study of the electron localization function (ELF)

    The nature of the T=T double bond (T = B, Al, Ga, In) in dialumene and its derivatives: topological study of the electron localization function (ELF) by Michalski, Michal, Gordon, Agnieszka J., Berski, Slawomir

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  5. 5
    Nature of the Bonding in the AuNgX (Ng = Ar, Kr, Xe; X = F, Cl, Br, I) Molecules. Topological Study on Electron Density and the Electron Localization Function (ELF)

    Nature of the Bonding in the AuNgX (Ng = Ar, Kr, Xe; X = F, Cl, Br, I) Molecules. Topological Study on Electron Density and the Electron Localization Function (ELF) by Makarewicz, Emilia, Gordon, Agnieszka J, Berski, Slawomir

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  6. 6
    New Findings on the Diels−Alder Reactions. An Analysis Based on the Bonding Evolution Theory

    New Findings on the Diels−Alder Reactions. An Analysis Based on the Bonding Evolution Theory by Berski, Slawomir, Andrés, Juan, Silvi, Bernard, Domingo, Luis R

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  7. 7
    On the multiple B-N bonding in boron compounds using the topological analysis of electron localization function (ELF)

    On the multiple B-N bonding in boron compounds using the topological analysis of electron localization function (ELF) by Berski, Slawomir, Latajka, Zdzislaw, Gordon, Agnieszka J

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  8. 8
    Curly arrows meet electron density transfers in chemical reaction mechanisms: from electron localization function (ELF) analysis to valence-shell electron-pair repulsion (VSEPR) inspired interpretation

    Curly arrows meet electron density transfers in chemical reaction mechanisms: from electron localization function (ELF) analysis to valence-shell electron-pair repulsion (VSEPR) in... by Andrés, Juan, Berski, S awomir, Silvi, Bernard

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  9. 9
    Understanding the molecular mechanism of the chlorine atom transfer between ammonia and hypochlorous acid with electron localisation function (ELF)

    Understanding the molecular mechanism of the chlorine atom transfer between ammonia and hypochlorous acid with electron localisation function (ELF) by Michalski, Michal, Berski, Slawomir

    Published in Molecular physics
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  10. 10
    The Joint Use of Catastrophe Theory and Electron Localization Function to Characterize Molecular Mechanisms. A Density Functional Study of the Diels−Alder Reaction between Ethylene and 1,3-Butadiene

    The Joint Use of Catastrophe Theory and Electron Localization Function to Characterize Molecular Mechanisms. A Density Functional Study of the Diels−Alder Reaction between Ethylene... by Berski, Slawomir, Andrés, Juan, Silvi, Bernard, Domingo, Luis R

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  11. 11
    Dimeric nature of N-coordinated Mg and Ca ions in metaloorganic compounds. The topological analysis of ELF functions for Mg–Mg and Ca–Ca bonds

    Dimeric nature of N-coordinated Mg and Ca ions in metaloorganic compounds. The topological analysis of ELF functions for Mg–Mg and Ca–Ca bonds by Berski, Sławomir, Durlak, Piotr

    Published in Polyhedron
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  12. 12
    The mechanism of Claisen rearrangement of allyl phenyl ether from the perspective of topological analysis of the ELF

    The mechanism of Claisen rearrangement of allyl phenyl ether from the perspective of topological analysis of the ELF by Berski, S awomir, Durlak, Piotr

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  13. 13
    Theoretical insights and quantitative prediction of the nature of boron–chalcogen (O, S, Se, Te) interactions using the electron density and the electron localisation function (ELF)

    Theoretical insights and quantitative prediction of the nature of boron–chalcogen (O, S, Se, Te) interactions using the electron density and the electron localisation function (ELF... by Michalski, Michal, Gordon, Agnieszka J., Berski, Slawomir

    Published in Polyhedron
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  14. 14
    Matrix-isolation and computational study of the HXeY⋯H2O complexes (Y = Cl, Br, and I)

    Matrix-isolation and computational study of the HXeY⋯H2O complexes (Y = Cl, Br, and I) by Tsuge, Masashi, Berski, Sławomir, Räsänen, Markku, Latajka, Zdzisław, Khriachtchev, Leonid

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  15. 15
    N‑Activated 1,3-Benzoxazine Monomer as a Key Agent in Polybenzoxazine Synthesis

    N‑Activated 1,3-Benzoxazine Monomer as a Key Agent in Polybenzoxazine Synthesis by Trybuła, Danuta, Marszałek-Harych, Aleksandra, Gazińska, Małgorzata, Berski, Sławomir, Jędrzkiewicz, Dawid, Ejfler, Jolanta

    Published in Macromolecules
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  16. 16
    Topological analysis of electron localisation function: Unlocking the nature of B C chemical bond. Possible existence of multiple bonds B C and B C

    Topological analysis of electron localisation function: Unlocking the nature of B C chemical bond. Possible existence of multiple bonds B C and B C by Mierzwa, Grzegorz, Gordon, Agnieszka J., Berski, Slawomir

    Published in Polyhedron
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  17. 17
    Theoretical studies on the molecular structure, conformational preferences, topological and vibrational analysis of allicin

    Theoretical studies on the molecular structure, conformational preferences, topological and vibrational analysis of allicin by Durlak, Piotr, Berski, Sſawomir, Latajka, Zdzisſaw

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  18. 18
    The nature of the triple B B, double, B B, single, B–B, and one-electron, B.B boron-boron bonds from the topological analysis of electron localisation function (ELF) perspective

    The nature of the triple B B, double, B B, single, B–B, and one-electron, B.B boron-boron bonds from the topological analysis of electron localisation function (ELF) perspective by Mierzwa, Grzegorz, Gordon, Agnieszka J., Berski, Slawomir

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  19. 19
    The nature of the triple BB, double, BB, single, B–B, and one-electron, B.B boron-boron bonds from the topological analysis of electron localisation function (ELF) perspective

    The nature of the triple BB, double, BB, single, B–B, and one-electron, B.B boron-boron bonds from the topological analysis of electron localisation function (ELF) perspective by Mierzwa, Grzegorz, Gordon, Agnieszka J., Berski, Slawomir

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  20. 20
    Characterisation of the reaction mechanism between ammonia and formaldehyde from the topological analysis of ELF and catastrophe theory perspective

    Characterisation of the reaction mechanism between ammonia and formaldehyde from the topological analysis of ELF and catastrophe theory perspective by Ćmikiewicz, Agnieszka, Gordon, Agnieszka J., Berski, Sławomir

    Published in Structural chemistry
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