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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg27-Feb-2024TSA3A4Primdiaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPCC-PVDZ GEN-2767.81959780; Eh
thumbnail.jpeg27-Feb-2024TSB4B5diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPCC-PVDZ GEN-2767.81095975; Eh
thumbnail.jpeg27-Feb-2024TSC1C2diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPCC-PVDZ GEN-2767.77613248; Eh
thumbnail.jpeg27-Feb-2024B6diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-2767.91379696; Eh
thumbnail.jpeg27-Feb-2024B2diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-2767.83792773; Eh
thumbnail.jpeg27-Feb-2024TSB63adiaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPCC-PVDZ GEN-2767.88820573; Eh
thumbnail.jpeg27-Feb-2024B5diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-2767.88619074; Eh
thumbnail.jpeg27-Feb-2024TSB3B4diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPCC-PVDZ GEN-2767.81357024; Eh
thumbnail.jpeg27-Feb-2024C1diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-2767.79457540; Eh
thumbnail.jpeg27-Feb-2024B4diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-2767.85570528; Eh
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