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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required1-Feb-2017/D3(6140)-C68 Sc3N@D3(6140)-C68Cl12Moreno Vicente, AntonioADF; 2013; 01Geometry optimizationDFTTZP-23.68806614; Eh
Login required1-Feb-2017/D5h(271)-C50 Ca@D5h(271)-C50ClMoreno Vicente, AntonioADF; 2013; 01Geometry optimizationDFTTZP-16.00023850; Eh
Login required2-Feb-2017/D5h(271)-C50 Ca@D5h(271)-C50H20Moreno Vicente, AntonioADF; 2013; 01Geometry optimizationDFTTZP-18.87727398; Eh
Login required1-Feb-2017/Ih-C60 Ca@Ih-C60ClMoreno Vicente, AntonioADF; 2013; 01Geometry optimizationDFTTZP-19.34579728; Eh
Login required1-Feb-2017/Cs(39663)-C82 Y3N@Cs(39663)-C82F2Moreno Vicente, AntonioADF; 2013; 01Geometry optimizationDFTTZP-27.67180303; Eh
Login required1-Feb-2017/Ih(7)-C80 Sc3N@Ih(7)-C80H6Moreno Vicente, AntonioADF; 2013; 01Geometry optimizationDFTTZP-27.47416130; Eh
Login required2-Feb-2017/D5h(271)-C50 D5h(271)-C50F4Moreno Vicente, AntonioADF; 2013; 01Geometry optimizationDFTTZP-16.39216727; Eh
Login required1-Feb-2017/D5h-C70 D5h-C70FMoreno Vicente, AntonioADF; 2013; 01Geometry optimizationDFTTZP-22.59599638; Eh
Login required1-Feb-2017/C2v(1809)-C60 Ca@C2v(1809)-C60H4Moreno Vicente, AntonioADF; 2013; 01Geometry optimizationDFTTZP-19.82672167; Eh
Login required1-Feb-2017/D5h(271)-C50 Sr@D5h(271)-C50ClMoreno Vicente, AntonioADF; 2013; 01Geometry optimizationDFTTZP-15.98939047; Eh
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