Browsing by Author Central, ioChem-BD

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PreviewTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetLinksEnergySolv.Vibr.Orb.
thumbnail.jpeg000000022 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--495.636596433; Eh
thumbnail.jpeg000000023 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--700.988489839; Eh
thumbnail.jpeg000000025 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--1075.71716033; Eh
thumbnail.jpeg000000026 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--998.138218772; Eh
thumbnail.jpeg000000027 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--2776.14971130; Eh
thumbnail.jpeg000000028 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--587.794884249; Eh
thumbnail.jpeg000000029 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--397.256292251; Eh
thumbnail.jpeg000000030 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--512.620494812; Eh
thumbnail.jpeg000000031 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--1065.21047194; Eh
thumbnail.jpeg000000032 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--720.845570897; Eh
thumbnail.jpeg000000033 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--612.995587088; Eh
thumbnail.jpeg000000034 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--614.208224200; Eh
thumbnail.jpeg000000035 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--991.868195555; Eh
thumbnail.jpeg000000036 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--649.303454246; Eh
thumbnail.jpeg000000037 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--685.144385310; Eh
thumbnail.jpeg000000038 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--534.870193114; Eh
thumbnail.jpeg000000039 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--458.532395536; Eh
thumbnail.jpeg000000040 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--611.191628533; Eh
thumbnail.jpeg000000041 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--1424.88792437; Eh
thumbnail.jpeg000000042 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE--799.345442869; Eh