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Showing results 80 to 99 of 232 < previous   next >
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg19-Oct-2022n2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-108.9596463; Eh
thumbnail.jpeg18-Oct-2022n2oBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-183.6955188; Eh
thumbnail.jpeg19-Oct-2022n2oBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-183.6955188; Eh
thumbnail.jpeg18-Oct-2022nh3Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-56.2049045; Eh
thumbnail.jpeg19-Oct-2022nh3Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-56.2049045; Eh
thumbnail.jpeg18-Oct-2022o2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureUHFAUG-CC-PVDZ-149.6422784; Eh
thumbnail.jpeg19-Oct-2022o2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureUHFAUG-CC-PVDZ-149.6422784; Eh
thumbnail.jpeg18-Oct-2022pa1Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-78.0433217; Eh
thumbnail.jpeg19-Oct-2022pa1Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-78.0433217; Eh
thumbnail.jpeg19-Oct-2022PA10-NH2-CHOBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-553.4183531; Eh
thumbnail.jpeg18-Oct-2022PA10-NH2-CHOBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-553.4183531; Eh
thumbnail.jpeg19-Oct-2022PA10-NH2-NO2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-644.1779089; Eh
thumbnail.jpeg18-Oct-2022PA10-NH2-NO2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-644.1779089; Eh
thumbnail.jpeg19-Oct-2022PA10-OH-CHOBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-573.2450409; Eh
thumbnail.jpeg18-Oct-2022PA10-OH-CHOBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-573.2450409; Eh
thumbnail.jpeg18-Oct-2022PA10-OH-NO2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-664.0042034; Eh
thumbnail.jpeg19-Oct-2022PA10-OH-NO2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-664.0042034; Eh
thumbnail.jpeg19-Oct-2022PA12-NH2-CHOBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-630.3139448; Eh
thumbnail.jpeg18-Oct-2022PA12-NH2-CHOBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-630.3139448; Eh
thumbnail.jpeg19-Oct-2022PA12-NH2-NO2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-721.0733955; Eh
Showing results 80 to 99 of 232 < previous   next >