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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg22-Jul-2018/ExcitedState/5S_State 5S_StatePetrus, EnricADF; 2016Geometry optimizationDFTTZP-
thumbnail.jpeg22-Jul-2018/ExcitedState/6S_State 6S_StatePetrus, EnricADF; 2016Geometry optimizationDFTTZP-
thumbnail.jpeg22-Jul-2018/ExcitedState/1T_State 1T_StatePetrus, EnricADF; 2016Geometry optimizationDFTTZP-3.84886214; Eh
thumbnail.jpeg22-Jul-2018/ExcitedState/10S_State 10S_StatePetrus, EnricADF; 2016Geometry optimizationDFTTZP-
thumbnail.jpeg22-Jul-2018/ExcitedState/2S_State 2S_StatePetrus, EnricADF; 2016Geometry optimizationDFTTZP-
Login required30-Apr-2019/U_Nb/3_U/4iso 4isoPetrus, EnricADF; 2016Geometry optimizationDFTTZP-
Login required30-Apr-2019/U_Nb/2_U/3iso 3isoPetrus, EnricADF; 2016Geometry optimizationDFTTZP-
Login required30-Apr-2019/U_Nb/2_U/1iso 1isoPetrus, EnricADF; 2016Geometry optimizationDFTTZP-
Login required30-Apr-2019/U_Nb/3_U/1iso 1isoPetrus, EnricADF; 2016Geometry optimizationDFTTZP-
Login required30-Apr-2019/U_Nb/3_U/2iso 2isoPetrus, EnricADF; 2016Geometry optimizationDFTTZP-
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