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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg24-Jul-2020H2Mo2O7Petrus, EnricADF; 2019Geometry optimizationPBETZP-
thumbnail.jpeg24-Jul-2020HMo5O16Petrus, EnricADF; 2019Geometry optimizationPBETZP-
thumbnail.jpeg26-Mar-2018C-6x6Ortuño, Manuelvasp; 5.3.5; 31Mar14 (build May 07 2014 16:01:45) complexGeometry optimizationPBE--724.69156366; eV
thumbnail.jpeg26-Mar-2018C2Ortuño, Manuelvasp; 5.3.5; 31Mar14 (build Jul 4 2017 09:52:38) complexFrequenciesPBE--1110.80821494; eV
thumbnail.jpeg26-Mar-2018TS-C2Ortuño, Manuelvasp; 5.3.5; 31Mar14 (build May 07 2014 16:01:45) complexFrequenciesPBE--1109.96085680; eV
thumbnail.jpeg26-Mar-2018A4Ortuño, Manuelvasp; 5.3.5; 31Mar14 (build Jul 4 2017 09:52:38) complexFrequenciesPBE--633.69913096; eV
thumbnail.jpeg24-Jul-2020H2Mo5O17Petrus, EnricADF; 2019Geometry optimizationPBETZP-
thumbnail.jpeg26-Mar-2018A6Ortuño, Manuelvasp; 5.3.5; 31Mar14 (build Jul 4 2017 09:52:38) complexFrequenciesPBE--633.56975145; eV
thumbnail.jpeg26-Mar-2018TS-A6Ortuño, Manuelvasp; 5.3.5; 31Mar14 (build Jul 4 2017 09:52:38) complexFrequenciesPBE--633.19987741; eV
thumbnail.jpeg24-Jul-2020Mo7O23Petrus, EnricADF; 2019Geometry optimizationPBETZP-
Results 31-40 of 1309 (Search time: 0.001 seconds).