Search        

Current filters:
Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg20-Jan-2021OxojatrophadieneSemenov, ValentinGaussian; 09; IA32W-G09RevA.02Geometry optimization MinimumRM062XCC-PVQZ AUG-CC-PVQZ GEN-2415.67970973; Eh
thumbnail.jpeg20-Jan-2021Lobatin_BSemenov, ValentinGaussian; 09; IA32W-G09RevA.02Geometry optimization MinimumRM062XCC-PVQZ AUG-CC-PVQZ GEN-1303.18697609; Eh
thumbnail.jpeg20-Jan-2021AcantholactamSemenov, ValentinGaussian; 09; IA32W-G09RevA.02Geometry optimization MinimumRM062XCC-PVTZ AUG-CC-PVTZ GEN-1916.99166231; Eh
thumbnail.jpeg20-Jan-2021Korundamine_ASemenov, ValentinGaussian; 09; IA32W-G09RevA.02Geometry optimization MinimumRM062XCC-PVTZ AUG-CC-PVTZ GEN-2531.17040365; Eh
thumbnail.jpeg20-Jan-2021CycleanineSemenov, ValentinGaussian; 09; IA32W-G09RevA.02Geometry optimization MinimumRM062XCC-PVQZ AUG-CC-PVQZ GEN-2034.15170065; Eh
thumbnail.jpeg20-Jan-202110_-HydroxyusambarensineSemenov, ValentinGaussian; 09; IA32W-G09RevA.02Geometry optimization MinimumRM062XCC-PVTZ AUG-CC-PVTZ GEN-1416.14601340; Eh
thumbnail.jpeg20-Jan-2021VertineSemenov, ValentinGaussian; 09; IA32W-G09RevA.02Geometry optimization MinimumRM062XCC-PVTZ AUG-CC-PVTZ GEN-1439.04368316; Eh
thumbnail.jpeg20-Jan-2021Neoquassin_etherSemenov, ValentinGaussian; 09; IA32W-G09RevA.02Geometry optimization MinimumRM062XCC-PVTZ AUG-CC-PVTZ GEN-2538.93119220; Eh
thumbnail.jpeg20-Jan-2021QuinineSemenov, ValentinGaussian; 09; IA32W-G09RevA.02Geometry optimization MinimumRM062XCC-PVQZ AUG-CC-PVQZ GEN-1036.51136628; Eh
thumbnail.jpeg22-Mar-2020/M062X_BS1_optimized_structures m062_clusterG. Algarra, AndrésGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRM062X6-31G(D,P) SDDALL GEN-2432.93926043; Eh
Results 11-20 of 595 (Search time: 0.002 seconds).