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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg29-Jul-2021i211103+i131102-i342116+i000000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexFrequenciesDFT--177.75677576; eV
thumbnail.jpeg29-Jul-2021i211103+i131102-i34220c+i000000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexFrequenciesDFT--177.92330326; eV
thumbnail.jpeg29-Jun-2020i212101García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--160.37160901; eV
thumbnail.jpeg30-Jun-2020i212101García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--160.37160901; eV
thumbnail.jpeg29-Jul-2021i212101+i100101-i312103+i000000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexFrequenciesDFT--165.23077546; eV
thumbnail.jpeg29-Jul-2021i212101+i101101-i313101+i000000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexFrequenciesDFT--174.51799230; eV
thumbnail.jpeg29-Jul-2021i212101+i101101-i313104+i000000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexFrequenciesDFT--175.08201941; eV
thumbnail.jpeg29-Jul-2021i212101+i110101-i322103+i000000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexFrequenciesDFT--170.83082367; eV
thumbnail.jpeg29-Jul-2021i212101+i111101-i323102+i000000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexFrequenciesDFT--178.32237979; eV
thumbnail.jpeg29-Jul-2021i212101+i111102-i323104+i000000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexFrequenciesDFT--177.17536033; eV
thumbnail.jpeg29-Jul-2021i212101+i120101-i332103+i000000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexFrequenciesDFT--174.81385986; eV
thumbnail.jpeg29-Jul-2021i212101+i121101-i333101+i000000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexFrequenciesDFT--182.00823111; eV
thumbnail.jpeg29-Jul-2021i212101+i121101-i33310b+i000000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexFrequenciesDFT--182.31810249; eV
thumbnail.jpeg29-Jul-2021i212101+i121102-i333103+i000000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexFrequenciesDFT--178.75016103; eV
thumbnail.jpeg29-Jul-2021i212101+i121102-i33310d+i000000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexFrequenciesDFT--181.38264289; eV
thumbnail.jpeg29-Jul-2021i212101+i130101-i342101+i000000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexFrequenciesDFT--178.66887228; eV
thumbnail.jpeg29-Jul-2021i212101+i130101-i342102+i000000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexFrequenciesDFT--178.57046144; eV
thumbnail.jpeg29-Jul-2021i212101+i131102-i343102+i000000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexFrequenciesDFT--185.93016444; eV
thumbnail.jpeg29-Jul-2021i212101+i131102-i34310c+i000000García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexFrequenciesDFT--185.98255375; eV
thumbnail.jpeg29-Jun-2020i212102García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--159.96191974; eV