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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg24-Feb-2020/SupportingStructures/Profiles/M062X/Adducts I_N_W_W_M062XPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM062XCC-PVTZ-849.588773852; Eh
thumbnail.jpeg24-Feb-2020/SupportingStructures/Profiles/M062X/Minima Benzaldehyde_M062XPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM062XCC-PVTZ-345.562788334; Eh
thumbnail.jpeg24-Feb-2020/SupportingStructures/Profiles/M062X/Minima NButylamine_M062XPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM062XCC-PVTZ-213.775880180; Eh
thumbnail.jpeg24-Feb-2020/SupportingStructures/Profiles/M062X/Minima Water_M062XPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM062XCC-PVTZ-76.4323158176; Eh
thumbnail.jpeg24-Feb-2020/SupportingStructures/Benchmark/m062x BenzanaldehydePérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM062X6-31+G(D,P)-345.453217531; Eh
thumbnail.jpeg24-Feb-2020/SupportingStructures/Benchmark/m062x HemiaminalPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM062X6-31+G(D,P)-559.180059683; Eh
thumbnail.jpeg24-Feb-2020/SupportingStructures/Benchmark/m062x NButylaminePérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM062X6-31+G(D,P)-213.710110806; Eh
thumbnail.jpeg24-Feb-2020/SupportingStructures/Benchmark/m062x IminePérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM062X6-31+G(D,P)-482.766459664; Eh
thumbnail.jpeg24-Feb-2020/SupportingStructures/Benchmark/m062x WaterPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM062X6-31+G(D,P)-76.4034997987; Eh
thumbnail.jpeg24-Feb-2020/SupportingStructures/Profiles/M062X/Adducts A_W_M062XPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM062XCC-PVTZ-422.002807824; Eh
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