1. Institute of Chemical Research of Catalonia

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Showing results 9910 to 9929 of 62999 < previous   next >
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2902-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1402.18489504; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2903-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1402.00084696; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2904-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1402.17201005; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2905-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1402.61350552; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2906-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1402.80078243; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2907-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1402.57738750; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2908-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1402.48920615; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2909-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1402.76359650; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2910-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1403.05349354; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2911-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1403.06855178; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2912-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1402.77595946; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2913-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1402.53288988; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2914-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1402.76195063; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2915-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1403.16790005; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2916-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1403.03156041; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2917-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1402.59871994; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2918-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1402.44784628; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2919-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1402.43960946; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2920-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1402.43860451; eV
thumbnail.jpeg16-Feb-2021/CO2-adsorption CO₂-ref-au-H2O-CO2-t-2921-fsDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--1402.42842237; eV
Showing results 9910 to 9929 of 62999 < previous   next >