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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required2-Mar-2019Monoterpenes-E-M06-2X_6-31+(d,p)Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X--390.854737590; Eh
Login required2-Mar-2019Monoterpenes-A-M06-2X_6-31+(d,p)Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X--390.806363786; Eh
Login required2-Mar-2019Monoterpenes-28-CBS-QB3Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYP; RCCSD; RMP4SDQ-FC; RMP2-FC; CBS-QB3--389.7379426; Eh
Login required2-Mar-2019Monoterpenes-24-CBS-QB3Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYP; RCCSD; RMP4SDQ-FC; RMP2-FC; CBS-QB3--389.7385567; Eh
Login required2-Mar-2019Monoterpenes-20-CBS-QB3Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYP; RCCSD; RMP4SDQ-FC; RMP2-FC; CBS-QB3--389.7448699; Eh
Login required2-Mar-2019Monoterpenes-13-CBS-QB3Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYP; RCCSD; RMP4SDQ-FC; RMP2-FC; CBS-QB3--389.7484875; Eh
Login required2-Mar-2019Monoterpenes-04-CBS-QB3Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYP; RCCSD; RMP4SDQ-FC; RMP2-FC; CBS-QB3--389.7542558; Eh
Login required2-Mar-2019Monoterpenes-01-CBS-QB3Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYP; RCCSD; RMP4SDQ-FC; RMP2-FC; CBS-QB3--389.7678947; Eh
Login required2-Mar-2019Monoterpenes-TS(C-G)-M06-2X_6-31+(d,p)Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRM062X--390.828603434; Eh
Login required2-Mar-2019Monoterpenes-TS(A-B)-M06-2X_6-31+(d,p)Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRM062X--390.789984638; Eh
Results 151-160 of 182 (Search time: 0.001 seconds).