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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 2-Sep-2023 | /P_radicals/dippf/dippf+Ph-rad dippf+Ph-rad | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | UMN15L | DEF2SVP | -3035.49095192; Eh | |||
 | 2-Sep-2023 | /P_radicals/dppf/dppf+Me-cat dppf+Me-cat | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RMN15L | DEF2SVP | -3295.72924162; Eh | |||
 | 2-Sep-2023 | /P_radicals/dppf/dppf+Me-rad dppf+Me-rad | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | UMN15L | DEF2SVP | -3295.85569427; Eh | |||
 | 2-Sep-2023 | /P_radicals/PCy3/PhPCy3-rad PhPCy3-rad | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | UMN15L | DEF2SVP | -1276.81260375; Eh | |||
 | 2-Sep-2023 | /P_radicals/PCy3/PCy3 PCy3 | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RMN15L | DEF2SVP | -1045.64786904; Eh | |||
 | 2-Sep-2023 | /Me_radical_addn/mXylene+Me-rad_product_5pos mXylene+Me-rad_product_5pos | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | UMN15L | DEF2SVP | -350.078478673; Eh | |||
 | 2-Sep-2023 | /Me_radical_addn/2iodomxylene 2iodomxylene | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RMN15L | DEF2SVP | -606.421907294; Eh | |||
 | 2-Sep-2023 | /P_radicals/PCy3/PhPCy3-cat PhPCy3-cat | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RMN15L | DEF2SVP | -1276.69750846; Eh | |||
 | 2-Sep-2023 | /P_radicals/dippf/dippf dippf | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RMN15L | DEF2SVP | -2804.31692940; Eh |
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