Browsing by Author Central, ioChem-BD

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PreviewTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetLinksEnergySolv.Vibr.Orb.
thumbnail.jpeg000147641 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---532.033206555; Eh
thumbnail.jpeg000147642 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---496.114981309; Eh
thumbnail.jpeg000147643 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---719.190957617; Eh
thumbnail.jpeg000147646 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---726.176397222; Eh
thumbnail.jpeg000147648 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---777.795978320; Eh
thumbnail.jpeg000147651 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---1220.52255311; Eh
thumbnail.jpeg000147652 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---458.460307599; Eh
thumbnail.jpeg000147653 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---1331.78067260; Eh
thumbnail.jpeg000147654 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---988.651126963; Eh
thumbnail.jpeg000147655 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---1027.90453041; Eh
thumbnail.jpeg000147656 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---1145.65458462; Eh
thumbnail.jpeg000147658 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---504.106596920; Eh
thumbnail.jpeg000147659 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---516.636763594; Eh
thumbnail.jpeg000147660 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---681.686542561; Eh
thumbnail.jpeg000147662 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---571.341951348; Eh
thumbnail.jpeg000147665 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---1089.68768395; Eh
thumbnail.jpeg000147667 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---1239.95242253; Eh
thumbnail.jpeg000147671 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---1470.57660685; Eh
thumbnail.jpeg000147673 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---1011.18350479; Eh
thumbnail.jpeg000147675 Central, ioChem-BDGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE---1088.49672369; Eh