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Showing results 190 to 209 of 232 < previous   next >
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
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
thumbnail.jpeg18-Oct-2022PMI3-OH-NO2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-558.1987811; Eh
thumbnail.jpeg18-Oct-2022pmi4Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-372.7276946; Eh
thumbnail.jpeg19-Oct-2022pmi4Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-372.7276946; Eh
thumbnail.jpeg19-Oct-2022PMI4-NH2-CHOBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-540.5450437; Eh
thumbnail.jpeg18-Oct-2022PMI4-NH2-CHOBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-540.5450437; Eh
thumbnail.jpeg19-Oct-2022PMI4-NH2-NO2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-631.2798044; Eh
thumbnail.jpeg18-Oct-2022PMI4-NH2-NO2Besalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-631.2798044; Eh
thumbnail.jpeg19-Oct-2022PMI4-OH-CHOBesalú-Sala, PauGaussian; 16; ES64L-G16RevA.03Single point StructureRHFAUG-CC-PVDZ-560.3608412; Eh
Showing results 190 to 209 of 232 < previous   next >