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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg20-Jul-2017/surfaces In2O3(111)_Ovac1Capdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complexGeometry optimization---1087.24742402; eV
thumbnail.jpeg20-Jul-2017/C2H2_activation 111_C2H2_chemCapdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complexGeometry optimization---1119.24729808; eV
thumbnail.jpeg20-Jul-2017/C2H2_activation 111_Ovac_C2H2_physCapdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complexGeometry optimization---1111.23630657; eV
thumbnail.jpeg20-Jul-2017/C2H2_activation 111_Ovac_C2H2_chemCapdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complexGeometry optimization---1112.48798172; eV
thumbnail.jpeg20-Jul-2017/H2_activation 111_adIn_InH-OHCapdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complexGeometry optimization---1105.44752190; eV
thumbnail.jpeg20-Jul-2017/H2_activation 111_adIn_2xOHCapdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complexGeometry optimization---1106.73826407; eV
thumbnail.jpeg20-Jul-2017/H2_activation 111_Ovac_2xOHCapdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complexGeometry optimization---1096.18440432; eV
thumbnail.jpeg20-Jul-2017/H2_activation 111_2xOHCapdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complexGeometry optimization---1104.20202704; eV
thumbnail.jpeg20-Jul-2017/C2H2_activation 111_C2H2_physCapdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complexGeometry optimization---1117.99139020; eV
thumbnail.jpeg20-Jul-2017/H2_activation 111_InH-OHCapdevila-Cortada, Marçalvasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complexGeometry optimization---1101.84560757; eV
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