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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg11-Apr-2021/N_sulfonylguanidine n3-i1add-dcmSanchez Pladevall, BrunaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD6-31+G(D)-1338.54125041; Eh
thumbnail.jpeg11-Apr-2021/N_sulfonylguanidine n4-i1add-dcmSanchez Pladevall, BrunaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD6-31+G(D)-1631.32842962; Eh
thumbnail.jpeg11-Apr-2021/N_sulfonylguanidine n3-i1add-gpSanchez Pladevall, BrunaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRwB97XD6-31+G(D)-1338.52483781; Eh
thumbnail.jpeg11-Apr-2021/N_sulfonylguanidine n1-i1add-dcmSanchez Pladevall, BrunaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD6-31+G(D)-1405.19545168; Eh
thumbnail.jpeg11-Apr-2021/N_sulfonylguanidine n3-ts2-gpSanchez Pladevall, BrunaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRwB97XD6-31+G(D)-2213.88209412; Eh
thumbnail.jpeg11-Apr-2021/N_sulfonylguanidine n4-i4-mixSanchez Pladevall, BrunaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD6-31+G(D)-2573.36514740; Eh
thumbnail.jpeg11-Apr-2021/N_sulfonylguanidine cn-ptol-gpSanchez Pladevall, BrunaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD6-31+G(D)-689.300159695; Eh
thumbnail.jpeg11-Apr-2021/N_sulfonylguanidine n3-ts2-mixSanchez Pladevall, BrunaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRwB97XD6-31+G(D)-2213.90651920; Eh
thumbnail.jpeg11-Apr-2021/N_sulfonylguanidine n2-i2-dcmSanchez Pladevall, BrunaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD6-31+G(D)-1259.88424214; Eh
thumbnail.jpeg11-Apr-2021/N_sulfonylguanidine n1-i2-gpSanchez Pladevall, BrunaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD6-31+G(D)-1405.15531439; Eh
Results 11-20 of 94 (Search time: 0.002 seconds).