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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required2-Mar-2019Monoterpenes-O-M06-2X_6-31+(d,p)Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X--390.853139736; Eh
Login required2-Mar-2019Monoterpenes-P-M06-2X_6-31+(d,p)Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X--390.817667997; Eh
Login required2-Mar-2019Monoterpenes-K-M06-2X_6-31+(d,p)Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X--390.849545598; Eh
Login required2-Mar-2019Monoterpenes-F-M06-2X_6-31+(d,p)Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X--390.855200963; Eh
Login required2-Mar-2019Monoterpenes-J-M06-2X_6-31+(d,p)Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X--390.849975742; Eh
Login required2-Mar-2019Monoterpenes-I-M06-2X_6-31+(d,p)Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X--390.855526527; Eh
Login required2-Mar-2019Monoterpenes-N-M06-2X_6-31+(d,p)Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X--390.859876868; Eh
Login required2-Mar-2019Monoterpenes-G-M06-2X_6-31+(d,p)Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X--390.835595171; Eh
Login required2-Mar-2019Monoterpenes-H-M06-2X_6-31+(d,p)Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRM062X--390.824639790; Eh
Login required2-Mar-2019Monoterpenes-M-M06-2X_6-31+(d,p)Pahima, EfratGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRM062X--390.824224393; Eh
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