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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg13-Feb-2023/base-driven_skeletal_rearrangements_/anion10 12_anionGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBE1PBEDEF2SVP-653.741373274; Eh
thumbnail.jpeg13-Feb-2023/base-driven_skeletal_rearrangements_/anion32 34_anionGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBE1PBEDEF2SVP-653.753053106; Eh
thumbnail.jpeg13-Feb-2023/base-driven_skeletal_rearrangements_/anion32 32_anionGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBE1PBEDEF2SVP-653.729826221; Eh
thumbnail.jpeg13-Feb-2023/neutral_H 11Guo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBE1PBEDEF2SVP-654.270642918; Eh
thumbnail.jpeg13-Feb-2023/neutral_H 10Guo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBE1PBEDEF2SVP-654.277076908; Eh
thumbnail.jpeg13-Feb-2023/neutral_H 13Guo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBE1PBEDEF2SVP-654.264848432; Eh
thumbnail.jpeg13-Feb-2023/neutral_H 12Guo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBE1PBEDEF2SVP-654.261720715; Eh
thumbnail.jpeg13-Feb-2023/neutral_SPh 35_bGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBE1PBEDEF2SVP-1282.84389110; Eh
thumbnail.jpeg13-Feb-2023/neutral_SPh 37_bGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBE1PBEDEF2SVP-1282.84459692; Eh
thumbnail.jpeg13-Feb-2023/neutral_SPh 35_aGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBE1PBEDEF2SVP-1282.84444476; Eh
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