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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg13-Feb-2023/anion_SPh 40_anion_aGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBE1PBEDEF2SVP-1282.29909494; Eh
thumbnail.jpeg13-Feb-2023/anion_SPh 40_anion_bGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBE1PBEDEF2SVP-1282.29909494; Eh
thumbnail.jpeg13-Feb-2023/anion_SPh 42_anion_bGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBE1PBEDEF2SVP-1282.31087534; Eh
thumbnail.jpeg13-Feb-2023/base-driven_skeletal_rearrangements_/anion9 9_anion_AGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBE1PBEDEF2SVP-653.740945544; Eh
thumbnail.jpeg13-Feb-2023/base-driven_skeletal_rearrangements_/anion9 9_anion_BGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBE1PBEDEF2SVP-653.746063916; Eh
thumbnail.jpeg13-Feb-2023/base-driven_skeletal_rearrangements_/anion9 9_anion_CGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBE1PBEDEF2SVP-653.752569035; Eh
thumbnail.jpeg13-Feb-2023/base-driven_skeletal_rearrangements_/anion9 9_anion_DGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRPBE1PBEDEF2SVP-653.734878141; Eh
thumbnail.jpeg13-Feb-2023/base-driven_skeletal_rearrangements_/anion9 9_anion_EGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRPBE1PBEDEF2SVP-653.761511354; Eh
thumbnail.jpeg13-Feb-2023/base-driven_skeletal_rearrangements_/anion9 9_anion_TS1Guo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRPBE1PBEDEF2SVP-653.734391063; Eh
thumbnail.jpeg13-Feb-2023/base-driven_skeletal_rearrangements_/anion9 9_anion_TS2Guo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRPBE1PBEDEF2SVP-653.742908986; Eh
Results 41-50 of 170 (Search time: 0.001 seconds).