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Showing results 183 to 202 of 233 < previous   next >
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg19-Oct-2022pmi1Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-94.0453296; Eh
thumbnail.jpeg18-Oct-2022pmi2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-186.9396467; Eh
thumbnail.jpeg19-Oct-2022pmi2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-279.8333518; Eh
thumbnail.jpeg19-Oct-2022PMI2-NH2-CHOBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-354.7527538; Eh
thumbnail.jpeg18-Oct-2022PMI2-NH2-CHOBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-354.7527538; Eh
thumbnail.jpeg19-Oct-2022PMI2-NH2-NO2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-445.4877739; Eh
thumbnail.jpeg18-Oct-2022PMI2-NH2-NO2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-445.4877739; Eh
thumbnail.jpeg19-Oct-2022PMI2-OH-CHOBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-374.5699789; Eh
thumbnail.jpeg18-Oct-2022PMI2-OH-CHOBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-374.5699789; Eh
thumbnail.jpeg19-Oct-2022PMI2-OH-NO2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-465.3031107; Eh
thumbnail.jpeg18-Oct-2022PMI2-OH-NO2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-465.3031107; Eh
thumbnail.jpeg18-Oct-2022pmi3Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-279.8333518; Eh
thumbnail.jpeg19-Oct-2022pmi3Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-279.8333518; Eh
thumbnail.jpeg19-Oct-2022PMI3-NH2-CHOBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-447.6488522; Eh
thumbnail.jpeg18-Oct-2022PMI3-NH2-CHOBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-447.6488522; Eh
thumbnail.jpeg19-Oct-2022PMI3-NH2-NO2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-538.3837128; Eh
thumbnail.jpeg18-Oct-2022PMI3-NH2-NO2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-538.3837128; Eh
thumbnail.jpeg19-Oct-2022PMI3-OH-CHOBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-467.4652534; Eh
thumbnail.jpeg18-Oct-2022PMI3-OH-CHOBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-467.4652534; Eh
thumbnail.jpeg19-Oct-2022PMI3-OH-NO2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-558.1987811; Eh
Showing results 183 to 202 of 233 < previous   next >