Browsing by Author Kiriakidi, Sofia

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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg16-Jan-20231-red-tKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1139.9266952; Eh
thumbnail.jpeg20-Jan-20231-red-tKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1139.9266952; Eh
thumbnail.jpeg16-Jan-20231-sKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1138.7508447; Eh
thumbnail.jpeg20-Jan-20231-sKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1138.7508447; Eh
thumbnail.jpeg16-Jan-202310-sKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-362.3730327; Eh
thumbnail.jpeg20-Jan-202310-sKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-362.3730327; Eh
thumbnail.jpeg16-Jan-202311-sKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1502.3273807; Eh
thumbnail.jpeg20-Jan-202311-sKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1502.3273807; Eh
thumbnail.jpeg16-Jan-20232-sKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1525.8646841; Eh
thumbnail.jpeg20-Jan-20232-sKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1525.8646841; Eh
thumbnail.jpeg16-Jan-20233-sKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1525.861986; Eh
thumbnail.jpeg20-Jan-20233-sKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1525.861986; Eh
thumbnail.jpeg16-Jan-20234-sKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1525.8580785; Eh
thumbnail.jpeg20-Jan-20234-sKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1525.8580785; Eh
thumbnail.jpeg24-Jan-20235-sKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1525.8618983; Eh
thumbnail.jpeg16-Jan-20235-tKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1525.8467137; Eh
thumbnail.jpeg20-Jan-20235-tKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1525.8467137; Eh
thumbnail.jpeg16-Jan-20236-tKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1576.2366855; Eh
thumbnail.jpeg20-Jan-20236-tKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1576.2366855; Eh
thumbnail.jpeg16-Jan-20237-sKiriakidi, SofiaGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUB3PW91DEF2SVP-1576.2348318; Eh