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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg24-Apr-2019P41_P710_charge1_mult2Mates Torres, EricGaussian; 09; ES64L-G09RevE.01Geometry optimization MinimumUwB97XD6-31g(d,p); 6-31+g(d,p)-1871.50360607; Eh
thumbnail.jpeg24-Apr-2019G32_G89_charge1_mult4Mates Torres, EricGaussian; 09; ES64L-G09RevE.01Geometry optimization MinimumUwB97XD6-31g(d,p); 6-31+g(d,p)-1872.63661995; Eh
thumbnail.jpeg24-Apr-2019G32_P109_charge0_mult4Mates Torres, EricGaussian; 09; ES64L-G09RevE.01Geometry optimization MinimumUwB97XD6-31g(d,p); 6-31+g(d,p)-1872.20327501; Eh
thumbnail.jpeg24-Apr-2019G32_G89_charge0_mult1Mates Torres, EricGaussian; 09; ES64L-G09RevE.01Geometry optimization MinimumRwB97XD6-31g(d,p); 6-31+g(d,p)-1872.81500513; Eh
thumbnail.jpeg24-Apr-2019G32_G89_charge0_mult3Mates Torres, EricGaussian; 09; ES64L-G09RevE.01Geometry optimization MinimumUwB97XD6-31g(d,p); 6-31+g(d,p)-1872.77298417; Eh
thumbnail.jpeg24-Apr-2019G32_G89_charge1_mult2Mates Torres, EricGaussian; 09; ES64L-G09RevE.01Geometry optimization MinimumUwB97XD6-31g(d,p); 6-31+g(d,p)-1872.68726082; Eh
thumbnail.jpeg24-Apr-2019G32_P109_charge1_mult1Mates Torres, EricGaussian; 09; ES64L-G09RevE.01Geometry optimization MinimumRwB97XD6-31g(d,p); 6-31+g(d,p)-1872.10829688; Eh
thumbnail.jpeg24-Apr-2019G32_P109_charge0_mult2Mates Torres, EricGaussian; 09; ES64L-G09RevE.01Geometry optimization MinimumUwB97XD6-31g(d,p); 6-31+g(d,p)-1872.24662319; Eh
thumbnail.jpeg24-Apr-2019P12_P109_OOH-25Mates Torres, EricGaussian; 09; ES64L-G09RevE.01Geometry optimization MinimumUwB97XD6-31g(d,p); 6-31+g(d,p)-2022.55316763; Eh
thumbnail.jpeg24-Apr-2019P12_P109_OOH-52Mates Torres, EricGaussian; 09; ES64L-G09RevE.01Geometry optimization MinimumUwB97XD6-31g(d,p); 6-31+g(d,p)-2022.51609577; Eh
Results 11-20 of 239 (Search time: 0.003 seconds).