Browsing by Author Novotny, Jan

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Showing results 1 to 17 of 17
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg16-Aug-20221aNovotny, JanADF; 2019Single pointPBE0 == Not Default ==TZ2P-
thumbnail.jpeg16-Aug-20223aNovotny, JanADF; 2019Single pointPBE0 == Not Default ==TZ2P-
thumbnail.jpeg16-Aug-20225aNovotny, JanADF; 2019Single pointPBE0 == Not Default ==TZ2P-
thumbnail.jpeg16-Aug-20225bNovotny, JanADF; 2019Single pointPBE0 == Not Default ==TZ2P-
thumbnail.jpeg12-Sep-2022Ru_KP_CN_DMFA_1cNovotny, JanADF; 2019Single pointPBE0 == Not Default ==TZ2P-
thumbnail.jpeg12-Sep-2022Ru_KP_CN_DMFA_2cNovotny, JanADF; 2019Single pointPBE0 == Not Default ==TZ2P-
thumbnail.jpeg12-Sep-2022Ru_KP_Me_DMFA_1cNovotny, JanADF; 2019Single pointPBE0 == Not Default ==TZ2P-
thumbnail.jpeg12-Sep-2022Ru_KP_Me_DMFA_1cNMRNovotny, JanADF; 2019Single point NMR--
thumbnail.jpeg12-Sep-2022Ru_KP_Me_DMFA_2c+4cNovotny, JanADF; 2019Single pointPBE0 == Not Default ==TZ2P-
thumbnail.jpeg12-Sep-2022Ru_KP_Me_VAC_1cNMRNovotny, JanADF; 2019Single point NMR--
thumbnail.jpeg12-Sep-2022Ru_KP_Me_VAC_2cNovotny, JanADF; 2019Single pointPBE0 == Not Default ==TZ2P-
thumbnail.jpeg12-Sep-2022Ru_KP_OXMe_2aq_2cNovotny, JanADF; 2019Single pointPBE0 == Not Default ==TZ2P-
thumbnail.jpeg12-Sep-2022Ru_KP_OXMe_DMFA_2c+4cNovotny, JanADF; 2019Single pointPBE0 == Not Default ==TZ2P-
thumbnail.jpeg12-Sep-2022Ru_KP_OXMe_VAC_2cNovotny, JanADF; 2019Single pointPBE0 == Not Default ==TZ2P-
thumbnail.jpeg12-Sep-2022Ru_KP_OXMe_WAT_2cNovotny, JanADF; 2019Single pointPBE0 == Not Default ==TZ2P-
thumbnail.jpeg12-Sep-2022Ru_NAMI_Me_DMFA_1cNovotny, JanADF; 2019Single pointPBE0 == Not Default ==TZ2P-
thumbnail.jpeg12-Sep-2022Ru_NAMI_Me_DMFA_2c+4cNovotny, JanADF; 2019Single pointPBE0 == Not Default ==TZ2P-