Browsing by Author Villar-Yanez, Alba

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Showing results 1 to 20 of 87  next >
PreviewTitleAuthor(s)ProgramMethod(s)Basis SetEnergySolv.Vibr.
thumbnail.jpeg5MCC-Int2_(and_TBD-H(+))Villar-Yanez, AlbaGaussian; 16; AM64L-G16RevA.03RwB97XD6-311G(D,P)-1776.00730607; Eh
thumbnail.jpeg5MCC-Int_(and_TBD-H(+))Villar-Yanez, AlbaGaussian; 16; AM64L-G16RevA.03RwB97XD6-311G(D,P)-1397.14245263; Eh
thumbnail.jpeg5MCC-O-2_(with_TBD-H(+)_and_AcIm)Villar-Yanez, AlbaGaussian; 16; AM64L-G16RevA.03RwB97XD6-311G(D,P)-1776.02135116; Eh
thumbnail.jpeg5MCC-O_(and_TBD-H(+))Villar-Yanez, AlbaGaussian; 16; AM64L-G16RevA.03RwB97XD6-311G(D,P)-1397.15501828; Eh
thumbnail.jpeg5MCC-OAc_(with_TBD_and_Im-H)Villar-Yanez, AlbaGaussian; 16; AM64L-G16RevA.03RwB97XD6-311G(D,P)-1776.02885944; Eh
thumbnail.jpeg5MCC-OH_(and_TBD)Villar-Yanez, AlbaGaussian; 16; AM64L-G16RevA.03RwB97XD6-311G(D,P)-1397.16040105; Eh
thumbnail.jpeg6MCC-Int1_(and_TBD-H(+))Villar-Yanez, AlbaGaussian; 16; AM64L-G16RevA.03RwB97XD6-311G(D,P)-1397.14615689; Eh
thumbnail.jpeg6MCC-Int2_(and_TBD-H(+))Villar-Yanez, AlbaGaussian; 16; AM64L-G16RevA.03RwB97XD6-311G(D,P)-1776.01727014; Eh
thumbnail.jpeg6MCC-O-1_(and_TBD-H(+))Villar-Yanez, AlbaGaussian; 16; AM64L-G16RevA.03RwB97XD6-311G(D,P)-1397.14243556; Eh
thumbnail.jpeg6MCC-O-2_(with_TBD-H(+)_and_AcIm)Villar-Yanez, AlbaGaussian; 16; AM64L-G16RevA.03RwB97XD6-311G(D,P)-1776.01684527; Eh
thumbnail.jpeg6MCC-OAc_(with_TBD_and_Im-H)Villar-Yanez, AlbaGaussian; 16; AM64L-G16RevA.03RwB97XD6-311G(D,P)-1776.03950672; Eh
thumbnail.jpeg6MCC-OH_(and_TBD)Villar-Yanez, AlbaGaussian; 16; AM64L-G16RevA.03RwB97XD6-311G(D,P)-1397.15783113; Eh
thumbnail.jpegAcImVillar-Yanez, AlbaGaussian; 16; AM64L-G16RevA.03RwB97XD6-311G(D,P)-378.857579692; Eh
thumbnail.jpeg/Circular_Dichroism CD_(R)-2,3-allenolVillar-Yanez, AlbaADF; 2019SAOPTZP-
thumbnail.jpeg/Circular_Dichroism CD_(S)-2,3-allenolVillar-Yanez, AlbaADF; 2019SAOPTZP-
thumbnail.jpeg/Circular_Dichroism CD_Center_of_Cluster_0_(R)Villar-Yanez, AlbaADF; 2019SAOPTZP-
thumbnail.jpeg/Circular_Dichroism CD_Center_of_Cluster_0_(S)Villar-Yanez, AlbaADF; 2019SAOPTZP-
thumbnail.jpeg/Circular_Dichroism CD_Center_of_Cluster_1_(R)Villar-Yanez, AlbaADF; 2019SAOPTZP-
thumbnail.jpeg/Circular_Dichroism CD_Center_of_Cluster_1_(S)Villar-Yanez, AlbaADF; 2019SAOPTZP-
thumbnail.jpeg/Circular_Dichroism CD_Center_of_Cluster_2_(R)Villar-Yanez, AlbaADF; 2019SAOPTZP-
Showing results 1 to 20 of 87