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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 3-Oct-2019 | /ACET/SPE B5B6 | Artigas, Albert | Gaussian; 09; AM64L-G09RevD.01 | Single point Structure | RM06L | cc-pVTZ | -1839.1736592; Eh | |||
 | 12-Jun-2019 | /SPE A3P | Artigas, Albert | Gaussian; 09; ES64L-G09RevE.01 | Single point Structure | RM06L | cc-pVTZ | -3674.5760916; Eh | |||
 | 12-Jun-2019 | /SPE A3PP_EXO | Artigas, Albert | Gaussian; 09; ES64L-G09RevE.01 | Single point Structure | RM06L | cc-pVTZ | -4020.5368661; Eh | |||
 | 3-Oct-2019 | /C60ACET/SPE WILKINSON | Artigas, Albert | Gaussian; 09; AM64L-G09RevD.01 | Single point Structure | RM06L | cc-pVTZ | -3679.9782436; Eh | |||
 | 3-Oct-2019 | /C60ACET/SPE PRODUCT_56 | Artigas, Albert | Gaussian; 09; AM64L-G09RevD.01 | Single point Structure | RM06L | cc-pVTZ | -2441.392158; Eh | |||
 | 3-Oct-2019 | /C60ACET/SPE C6A8_56 | Artigas, Albert | Gaussian; 09; AM64L-G09RevD.01 | Single point Structure | RM06L | cc-pVTZ | -4048.3862242; Eh | |||
 | 3-Oct-2019 | /C60ACET/SPE B6PA7P_56 | Artigas, Albert | Gaussian; 09; AM64L-G09RevD.01 | Single point Structure | RM06L | cc-pVTZ | -3011.8762592; Eh | |||
 | 3-Oct-2019 | /C60ACET/SPE C6_56 | Artigas, Albert | Gaussian; 09; AM64L-G09RevD.01 | Single point Structure | RM06L | cc-pVTZ | -4048.4223645; Eh | |||
 | 3-Oct-2019 | /C60ACET/SPE C7_66 | Artigas, Albert | Gaussian; 09; AM64L-G09RevD.01 | Single point Structure | RM06L | cc-pVTZ | -4048.5115702; Eh | |||
 | 3-Oct-2019 | /C60ACET/SPE B5P | Artigas, Albert | Gaussian; 09; AM64L-G09RevD.01 | Single point Structure | RM06L | cc-pVTZ | -3971.0176389; Eh |
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