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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg8-Apr-2026(R)-TS1-RFArenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRwB97XDLANL2DZ 6-31G(D,P) GENECP-3268.45356006; Eh
thumbnail.jpeg8-Apr-2026(R)-TS1-RAArenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRwB97XDLANL2DZ 6-31G(D,P) GENECP-3268.45427733; Eh
thumbnail.jpeg8-Apr-2026(R)-TS1-RBArenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRwB97XDLANL2DZ 6-31G(D,P) GENECP-3268.45305182; Eh
thumbnail.jpeg8-Apr-2026(R)-TS1-RDArenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRwB97XDLANL2DZ 6-31G(D,P) GENECP-3268.43956196; Eh
thumbnail.jpeg8-Apr-2026(R)-TS1-REArenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRwB97XDLANL2DZ 6-31G(D,P) GENECP-3268.44492473; Eh
thumbnail.jpeg8-Apr-2026(R)-TS1-RCArenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDLANL2DZ 6-31G(D,P) GENECP-3268.45570837; Eh
thumbnail.jpeg8-Apr-2026(R)-TS3Arenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRwB97XDLANL2DZ 6-31G(D,P) GENECP-3268.50047364; Eh
thumbnail.jpeg8-Apr-2026(R)-TS2Arenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDLANL2DZ 6-31G(D,P) GENECP-3268.48447389; Eh
thumbnail.jpeg8-Apr-2026(R)-TS1-R-PH2Arenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRwB97XDLANL2DZ 6-31G(D,P) GENECP-2344.47166193; Eh
thumbnail.jpeg8-Apr-2026(R)-TS1-SAArenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRwB97XDLANL2DZ 6-31G(D,P) GENECP-3268.45131970; Eh
Results 2821-2830 of 2835 (Search time: 0.001 seconds).