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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 3-Oct-2019 | PRODUCT_56f_SOS | Artigas, Albert | Gaussian; 09; ES64L-G09RevE.01 | Single point Minimum | UB3LYP | - | -2785.28238905; Eh | |||
 | 3-Oct-2019 | PRODUCT_55_SOS | Artigas, Albert | Gaussian; 09; ES64L-G09RevE.01 | Geometry optimization Minimum | UB3LYP | - | -2785.29394384; Eh | |||
 | 3-Oct-2019 | TS1_55_TRIPLET | Artigas, Albert | Gaussian; 09; ES64L-G09RevE.01 | Geometry optimization TS | UB3LYP | - | -2785.23034467; Eh | |||
 | 3-Oct-2019 | PRODUCT_56d_SOS | Artigas, Albert | Gaussian; 09; ES64L-G09RevE.01 | Single point TS | UB3LYP | - | -2785.26534028; Eh | |||
 | 3-Oct-2019 | PRODUCT_56f_TRIPLET | Artigas, Albert | Gaussian; 09; ES64L-G09RevE.01 | Geometry optimization Minimum | UB3LYP | - | -2785.28167712; Eh | |||
 | 3-Oct-2019 | I2_66_SOS | Artigas, Albert | Gaussian; 09; ES64L-G09RevE.01 | Geometry optimization Minimum | UB3LYP | - | -2785.21968225; Eh | |||
 | 3-Oct-2019 | I1_66_TRIPLET | Artigas, Albert | Gaussian; 09; ES64L-G09RevE.01 | Geometry optimization Minimum | UB3LYP | - | -2785.24164119; Eh | |||
 | 3-Oct-2019 | I2_55_TRIPLET | Artigas, Albert | Gaussian; 09; ES64L-G09RevE.01 | Geometry optimization Minimum | UB3LYP | - | -2785.25534654; Eh | |||
 | 3-Oct-2019 | I1_56d_TRIPLET | Artigas, Albert | Gaussian; 09; ES64L-G09RevE.01 | Geometry optimization Minimum | UB3LYP | - | -2785.24241478; Eh | |||
 | 3-Oct-2019 | I2_55_Singlet_Open_Shell | Artigas, Albert | Gaussian; 09; ES64L-G09RevE.01 | Geometry optimization Minimum | UB3LYP | - | -2785.25534942; Eh |
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