Browsing by Author Stanczak, Agnieszka

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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg4-Mar-2019T_Cl_homo_B3LYP_BS2Stanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUB3LYP--
thumbnail.jpeg4-Mar-2019T_Cl_homo_B3LYP_PCMStanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUB3LYP--
thumbnail.jpeg4-Mar-2019T_Cl_homo_TPSShStanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUTPSSh--
thumbnail.jpeg4-Mar-2019T_Cl_homo_wB97XDStanczak, AgnieszkaGaussian; 09; ES64L-G09RevE.01Single point StructureUwB97XD--3371.53456446; Eh
thumbnail.jpeg4-Mar-2019T_Cl_Ph_B3LYP_BS2Stanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUB3LYP--
thumbnail.jpeg4-Mar-2019T_Cl_Ph_B3LYP_PCMStanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUB3LYP--
thumbnail.jpeg4-Mar-2019T_Cl_Ph_TPSShStanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUTPSSh--
thumbnail.jpeg4-Mar-2019T_Cl_Ph_wB97XDStanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUwB97XD--
thumbnail.jpeg4-Mar-2019T_Cl_TPSShStanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUTPSSh--
thumbnail.jpeg4-Mar-2019T_Cl_wB97XDStanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUwB97XD--
thumbnail.jpeg4-Mar-2019T_Ph_B3LYP_BS2Stanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUB3LYP--
thumbnail.jpeg4-Mar-2019T_Ph_B3LYP_PCMStanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUB3LYP--
thumbnail.jpeg4-Mar-2019T_Ph_TPSShStanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUTPSSh--
thumbnail.jpeg4-Mar-2019T_Ph_wB97XDStanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUwB97XD--
thumbnail.jpeg4-Mar-2019T_TPSShStanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUTPSSh--
thumbnail.jpeg4-Mar-2019T_wB97XDStanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUwB97XD--
thumbnail.jpeg4-Mar-2019TS1_B3LYP_BS2Stanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUB3LYP--
thumbnail.jpeg4-Mar-2019TS1_B3LYP_PCMStanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUB3LYP--2912.10001099; Eh
thumbnail.jpeg4-Mar-2019TS1_Cl_B3LYP_BS2Stanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUB3LYP--
thumbnail.jpeg4-Mar-2019TS1_Cl_B3LYP_PCMStanczak, AgnieszkaGaussian; 09; AM64L-G09RevC.01Single point StructureUB3LYP--