Browsing by Author Moreno Vicente, Antonio

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Showing results 46 to 58 of 58 < previous 
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required1-Feb-2017/D5h(271)-C50 Sr@D5h(271)-C50F10Moreno Vicente, AntonioADF; 2013; 01Geometry optimizationDFTTZP-17.49763714; Eh
Login required1-Feb-2017/D5h-C70 D5h-C70FMoreno Vicente, AntonioADF; 2013; 01Geometry optimizationDFTTZP-22.59599638; Eh
Login required1-Feb-2017/Ih(7)-C80 Sc3N@Ih(7)-C80H6Moreno Vicente, AntonioADF; 2013; 01Geometry optimizationDFTTZP-27.47416130; Eh
Login required1-Feb-2017/Ih-C60 Ca@Ih-C60ClMoreno Vicente, AntonioADF; 2013; 01Geometry optimizationDFTTZP-19.34579728; Eh
Login required1-Feb-2017/Ih-C60 Ih-C60FMoreno Vicente, AntonioADF; 2013; 01Geometry optimizationDFTTZP-19.30153198; Eh
Login required1-Feb-2017/Ih-C60 Ih-C60H2Moreno Vicente, AntonioADF; 2013; 01Geometry optimizationDFTTZP-19.46342343; Eh
Login required1-Feb-2017/Ih-C60 Sr@Ih-C60ClMoreno Vicente, AntonioADF; 2013; 01Geometry optimizationDFTTZP-19.34671925; Eh
thumbnail.jpeg18-Jul-2021Intermediate_666_2a_Moreno Vicente, AntonioADF; 2018Geometry optimizationPBETZP-32.54454497; Eh
thumbnail.jpeg18-Jul-2021Lu3N@C80Moreno Vicente, AntonioADF; 2018Geometry optimizationPBETZP-27.07909494; Eh
thumbnail.jpeg18-Jul-2021Product_2a_Moreno Vicente, AntonioADF; 2018Geometry optimizationPBETZP-32.58431538; Eh
thumbnail.jpeg18-Jul-2021Product_5Moreno Vicente, AntonioADF; 2018Geometry optimizationPBETZP-32.57320374; Eh
thumbnail.jpeg18-Jul-2021/TS2_2a_ TS2_2a_Moreno Vicente, AntonioADF; 2018Single point QuildPBETZP-
thumbnail.jpeg18-Jul-2021/TS2_2a_ TS2_2a__FreqMoreno Vicente, AntonioADF; 2018Single pointPBETZP-