Výsledky vyhľadávania
Názov Long-range 13C–31P J-coupling in group 10 element BMT complexes Autor Lemken Florian SAVANOCH - Ústav anorganickej chémie SAV Spoluautori Miranda V.M. Malkina Oľga 1956 SAVANOCH - Ústav anorganickej chémie SAV Akcia Design of Advanced Inorganic Materials - Workshop on the occasion of 70th anniversary of the institute of inorganic Chemistry SAS. vedecká konferencia : 3.5.2023 - 4.5.2023 : Congress centre SAS, Smolenice, Slovakia Zdroj.dok. Design of Advanced Inorganic Materials - Workshop on the occasion of 70th anniversary of the institute of inorganic Chemistry SAS : Book of abstracts. P. 18. - Bratislava, Slovakia : Institute of inorganic Chemistry Slovak academy of sciences, 2023 Kategória AFL - Postery z domácich konferencií Kategória (od 2022) V2 - Vedecký výstup publikačnej činnosti ako časť editovanej knihy alebo zborníka Typ výstupu abstrakt z podujatia Rok vykazovania 2023 
článok
Title Transmission of spin-polarization by π-orbitals Author Malkin Vladimír 1956 SAVANOCH - Ústav anorganickej chémie SAV Co-authors Lemken Florian SAVANOCH - Ústav anorganickej chémie SAV Asher James Richard SAVANOCH - Ústav anorganickej chémie SAV Hierso J-C. Bühl M. Malkina Oľga 1956 SAVANOCH - Ústav anorganickej chémie SAV Action Design of Advanced Inorganic Materials - Workshop on the occasion of 70th anniversary of the institute of inorganic Chemistry SAS. vedecká konferencia : 3.5.2023 - 4.5.2023 : Congress centre SAS, Smolenice, Slovakia Source document Design of Advanced Inorganic Materials - Workshop on the occasion of 70th anniversary of the institute of inorganic Chemistry SAS : Book of abstracts. P. 22. - Bratislava, Slovakia : Institute of inorganic Chemistry Slovak academy of sciences, 2023 Category AFL - Domestic conferences posters Category of document (from 2022) V2 - Vedecký výstup publikačnej činnosti ako časť editovanej knihy alebo zborníka Type of document abstrakt z podujatia Year 2023 článok
Title Transmission of spin-polarization by 𝝅-orbitals Author Malkin Vladimír 1956 SAVANOCH - Ústav anorganickej chémie SAV Co-authors Malkina Oľga 1956 SAVANOCH - Ústav anorganickej chémie SAV Lemken Florian SAVANOCH - Ústav anorganickej chémie SAV Asher James Richard SAVANOCH - Ústav anorganickej chémie SAV Action 17th International Congress of Quantum Chemistry ( 17 : 26.6. - 1.7. 2023 : Bratislava , Slovenská republika ) Source document 17th International Congress of Quantum Chemistry : book af abstract. P. 373. - Bratislava : International Academy of Quantum Molecular Science, 2023 Category AFL - Domestic conferences posters Category of document (from 2022) V2 - Vedecký výstup publikačnej činnosti ako časť editovanej knihy alebo zborníka Type of document abstrakt z podujatia Year 2023 článok
Title Combined Hückel and Perturbation Theory Approach for the Prediction of π Contributions to Indirect Spin-Spin Coupling in Conjugated Hydrocarbons Author Lemken Florian SAVANOCH - Ústav anorganickej chémie SAV Co-authors Asher James Richard SAVANOCH - Ústav anorganickej chémie SAV Malkina Oľga 1956 SAVANOCH - Ústav anorganickej chémie SAV Action 17th International Congress of Quantum Chemistry ( 17 : 26.6. - 1.7. 2023 : Bratislava , Slovenská republika ) Source document 17th International Congress of Quantum Chemistry : book af abstract. P. 297. - Bratislava : International Academy of Quantum Molecular Science, 2023 Category AFL - Domestic conferences posters Category of document (from 2022) V2 - Vedecký výstup publikačnej činnosti ako časť editovanej knihy alebo zborníka Type of document abstrakt z podujatia Year 2023 článok
Title Long-Range Indirect 13C-31P Coupling in Isostructural Nickel, Palladium, and Platinum Complexes Author Lemken Florian SAVANOCH - Ústav anorganickej chémie SAV Co-authors Miranda Victor M. Malkina Oľga 1956 SAVANOCH - Ústav anorganickej chémie SAV Action XVth Workshop on Modern Methods in Quantum Chemistry. medzinárodná konferencia ( 15 : 26.2.2023 - 3.3.2023 : Mariapfarr, Austria ) Source document XVth Workshop on Modern Methods in Quantum Chemistry. A joint workshop of the Technische Universität Berlin and the Institute of Inorganic Chemistry, SAS : Book of Abstracts. P. 20. - Bratislava, Slovakia : Institute of Inorganic Chemistry, Slovak Academy of Sciences, 2023 Category AFG - Abstracts of papers from foreign conferences Category of document (from 2022) V2 - Vedecký výstup publikačnej činnosti ako časť editovanej knihy alebo zborníka Type of document abstrakt z podujatia Year 2023 článok
Title Overcoming the gauge problem for g-tensor calculations in the framework of four-component DFT Author Mišenková Debora SAVANOCH - Ústav anorganickej chémie SAV Co-authors Lemken Florian SAVANOCH - Ústav anorganickej chémie SAV Repiský Michal Noga Jozef 1955 Malkina Oľga 1956 SAVANOCH - Ústav anorganickej chémie SAV Komorovský Stanislav 1982 SAVANOCH - Ústav anorganickej chémie SAV Source document CEST 2022. 18th Central European Symposium on Theoretical Chemistry 2022, Balatonszárszó, Hungary, 7th - 10th September 2022 : Program and book of abstracts. P. 49. - Hungary : Hungarian Chemical Society, 2022 ; CEST 2022. Central European Symposium on Theoretical Chemistry 2022 Category AFG - Abstracts of papers from foreign conferences Category of document (from 2022) O2 - Odborný výstup publikačnej činnosti ako časť knižnej publikácie alebo zborníka Type of document abstrakt z podujatia Year 2022 článok
Title Indirect nuclear spin-spin & hyperfine coupling pathway visualisation in heavy metal complexes Author Lemken Florian SAVANOCH - Ústav anorganickej chémie SAV Co-authors Malkina Oľga 1956 SAVANOCH - Ústav anorganickej chémie SAV Malkin Vladimír 1956 SAVANOCH - Ústav anorganickej chémie SAV Komorovský Stanislav 1982 SAVANOCH - Ústav anorganickej chémie SAV Source document Chemistry towards Biology 10 Instruct : programme. Abstract Booklet. P. 89. - Bratislava : The Institute of Chemistry, Slovak Academy of Sciences, 2022 / Hricovíni Miloš 1957 ; Jampílek Josef ; Pieratelli Roberta ; Stochel Grazyna ; Plavec Janez ; Perczel Andras ; Chemistry towards Biology (CTB10) - Instruct Structural Biology Meeting Category AFH - Abstracts of papers from domestic conferences Category of document (from 2022) V2 - Vedecký výstup publikačnej činnosti ako časť editovanej knihy alebo zborníka Type of document abstrakt z podujatia Year 2022 článok
Title The four-component DFT method for the calculation of the EPR g-tensor using a restricted magnetically balanced basis and London atomic orbitals Author Mišenková Debora SAVANOCH - Ústav anorganickej chémie SAV Co-authors Lemken Florian SAVANOCH - Ústav anorganickej chémie SAV Repiský Michal Noga Jozef 1955 Malkina Oľga 1956 SAVANOCH - Ústav anorganickej chémie SAV Komorovský Stanislav 1982 SAVANOCH - Ústav anorganickej chémie SAV Source document Journal of Chemical Physics. Vol. 157, no. 16 (2022), art. no. 164114 Category ADCA - Scientific papers in foreign journals registered in Current Contents Connect with IF (impacted) Category of document (from 2022) V3 - Vedecký výstup publikačnej činnosti z časopisu Type of document článok Year 2022 DOI 10.1063/5.0103928 File name Access Size Downloaded Type License The four-component DFT method for the calculation of the EPR g-tensor using a restricted magnetically balanced basis and London atomic orbitals.pdf Neprístupný/archív 6.7 MB 0 Publisher's version článok
Title Transmission of spin-polarization by pi-orbitals: an approach to assessing its effect on NMR spin-spin coupling and EPR hyperfine structure Author Malkina Oľga 1956 SAVANOCH - Ústav anorganickej chémie SAV Co-authors Lemken Florian SAVANOCH - Ústav anorganickej chémie SAV Asher James Richard SAVANOCH - Ústav anorganickej chémie SAV Hierso Jean-Cyrille Bühl Michael Malkin Vladimír 1956 SAVANOCH - Ústav anorganickej chémie SAV Source document Physical Chemistry Chemical Physics. Vol. 24, no. 32 (2022), p. 24039-24049 Category ADCA - Scientific papers in foreign journals registered in Current Contents Connect with IF (impacted) Category of document (from 2022) V3 - Vedecký výstup publikačnej činnosti z časopisu Type of document článok Year 2022 DOI 10.1039/d2cp03295c File name Access Size Downloaded Type License Transmission of spin-polarization by pi-orbitals _ an approach to assesing its effect on NMR spin-spin coupling and EPR hyperfine structure.pdf Neprístupný/archív 2.1 MB 0 Publisher's version článok
Title Visualization of EPR hyperfine structure coupling pathways Author Malkin Vladimír 1956 SAVANOCH - Ústav anorganickej chémie SAV Co-authors Lemken Florian SAVANOCH - Ústav anorganickej chémie SAV Komorovský Stanislav 1982 SAVANOCH - Ústav anorganickej chémie SAV Malkina Oľga 1956 SAVANOCH - Ústav anorganickej chémie SAV Source document CEST 2022. 18th Central European Symposium on Theoretical Chemistry 2022, Balatonszárszó, Hungary, 7th - 10th September 2022 : Program and book of abstracts. P. 59. - Hungary : Hungarian Chemical Society, 2022 ; CEST 2022. Central European Symposium on Theoretical Chemistry 2022 Category AFG - Abstracts of papers from foreign conferences Category of document (from 2022) O2 - Odborný výstup publikačnej činnosti ako časť knižnej publikácie alebo zborníka Type of document abstrakt z podujatia Year 2022 článok