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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg10-Mar-2021/SILVER/TS 33pin-Ag-TSMaza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRwB97XDLANL2DZ 6-31G(D,P) GENECP-2934.48172686; Eh
thumbnail.jpeg10-Mar-2021/SILVER/TS 1apin-Ag-TSMaza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRwB97XDLANL2DZ 6-31G(D,P) GENECP-2113.27363144; Eh
thumbnail.jpeg10-Mar-2021/LITHIUM 2cpindan-LiMaza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XD6-31G(D,P)-1208.6144886; Eh
thumbnail.jpeg21-Oct-2020TS3bSolé-Daura, AlbertGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDGENECP-
thumbnail.jpeg21-Oct-2020TS4Solé-Daura, AlbertGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDGENECP-
thumbnail.jpeg10-Mar-2021/LITHIUM 2apindan-LiMaza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XD6-31G(D,P)-977.6331662; Eh
thumbnail.jpeg10-Mar-2021/LITHIUM 2bpindan-LiMaza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XD6-31G(D,P)-1016.9338511; Eh
thumbnail.jpeg10-Mar-2021/LITHIUM 2c2pin-LiMaza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XD6-31G(D,P)-1099.6039717; Eh
thumbnail.jpeg10-Mar-2021/LITHIUM 2b2pin-LiMaza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XD6-31G(D,P)-907.9233176; Eh
thumbnail.jpeg10-Mar-2021/LITHIUM 2a2pin-LiMaza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XD6-31G(D,P)-868.6241817; Eh
Results 11-20 of 178 (Search time: 0.001 seconds).