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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 4-Sep-2023 | m06lSP_TSH1-4 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06L | 6-311+G(D,P) SDD GENECP | -1139.9523814; Eh | |||
 | 4-Sep-2023 | m06lSP_TSI1-5 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06L | 6-311+G(D,P) SDD GENECP | -1061.3032516; Eh | |||
 | 4-Sep-2023 | m06lSP_TSI4-5 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06L | 6-311+G(D,P) SDD GENECP | -1061.3250135; Eh | |||
 | 4-Sep-2023 | m06lSP_TSQ1-7 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06L | 6-311+G(D,P) SDD GENECP | -1139.9567527; Eh | |||
 | 4-Sep-2023 | m06lSP_TSQ4-7 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06L | 6-311+G(D,P) SDD GENECP | -1139.946812; Eh | |||
 | 4-Sep-2023 | m06SP_H1 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06 | 6-311+G(D,P) SDD GENECP | -1139.4521894; Eh | |||
 | 4-Sep-2023 | m06SP_H3 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06 | 6-311+G(D,P) SDD GENECP | -1139.427029; Eh | |||
 | 4-Sep-2023 | m06SP_H5 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06 | 6-311+G(D,P) SDD GENECP | -1139.4551257; Eh | |||
 | 4-Sep-2023 | m06SP_I1 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06 | 6-311+G(D,P) SDD GENECP | -1060.8602425; Eh | |||
 | 4-Sep-2023 | m06SP_I4 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06 | 6-311+G(D,P) SDD GENECP | -1060.8643556; Eh | |||
 | 4-Sep-2023 | m06SP_I5 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06 | 6-311+G(D,P) SDD GENECP | -1060.8563144; Eh | |||
 | 4-Sep-2023 | m06SP_Q1 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06 | 6-311+G(D,P) SDD GENECP | -1139.4498953; Eh | |||
 | 4-Sep-2023 | m06SP_Q4 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06 | 6-311+G(D,P) SDD GENECP | -1139.4556926; Eh | |||
 | 4-Sep-2023 | m06SP_Q7 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06 | 6-311+G(D,P) SDD GENECP | -1139.4400243; Eh | |||
 | 4-Sep-2023 | m06SP_TSH1-2 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06 | 6-311+G(D,P) SDD GENECP | -1139.4169107; Eh | |||
 | 4-Sep-2023 | m06SP_TSH1-4 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06 | 6-311+G(D,P) SDD GENECP | -1139.432498; Eh | |||
 | 4-Sep-2023 | m06SP_TSI1-5 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06 | 6-311+G(D,P) SDD GENECP | -1060.8359019; Eh | |||
 | 4-Sep-2023 | m06SP_TSI4-5 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06 | 6-311+G(D,P) SDD GENECP | -1060.8560634; Eh | |||
 | 4-Sep-2023 | m06SP_TSQ1-7 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06 | 6-311+G(D,P) SDD GENECP | -1139.4331713; Eh | |||
 | 4-Sep-2023 | m06SP_TSQ4-7 | García-Padilla, Eduardo | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM06 | 6-311+G(D,P) SDD GENECP | -1139.4275961; Eh |