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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 14-Sep-2023 | /Scaling_factors C2H2_(opt-freq)_-_M06-2X_6-311++G(2d,2p)_No_solvation | Nicolaou, Michael | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RM062X | 6-311++G(2D,2P) | -77.3199398617; Eh | |||
 | 14-Sep-2023 | /Scaling_factors CH4_(opt-freq)_-_M06-2X_6-311++G(2d,2p)_No_solvation | Nicolaou, Michael | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RM062X | 6-311++G(2D,2P) | -40.4997239290; Eh | |||
 | 14-Sep-2023 | /Scaling_factors CO2_(opt-freq)_-_M06-2X_6-311++G(2d,2p)_No_solvation | Nicolaou, Michael | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RM062X | 6-311++G(2D,2P) | -188.578889547; Eh | |||
 | 14-Sep-2023 | /Scaling_factors Cl2_(opt-freq)_-_M06-2X_6-311++G(2d,2p)_No_solvation | Nicolaou, Michael | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RM062X | 6-311++G(2D,2P) | -920.355447644; Eh | |||
 | 14-Sep-2023 | /Scaling_factors H2_(opt-freq)_-_M06-2X_6-311++G(2d,2p)_No_solvation | Nicolaou, Michael | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RM062X | 6-311++G(2D,2P) | -1.16888120185; Eh | |||
 | 14-Sep-2023 | /Scaling_factors F2_(opt-freq)_-_M06-2X_6-311++G(2d,2p)_No_solvation | Nicolaou, Michael | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RM062X | 6-311++G(2D,2P) | -199.502875019; Eh | |||
 | 14-Sep-2023 | /Scaling_factors CO_(opt-freq)_-_M06-2X_6-311++G(2d,2p)_No_solvation | Nicolaou, Michael | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RM062X | 6-311++G(2D,2P) | -113.312700929; Eh | |||
 | 14-Sep-2023 | /Scaling_factors C2H2_(opt-freq)_-_M06-2X_6-311G_No_solvation | Nicolaou, Michael | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RM062X | 6-311G | -77.2967034315; Eh | |||
 | 14-Sep-2023 | /Scaling_factors H2CO_(opt-freq)_-_M06-2X_6-31G_No_solvation | Nicolaou, Michael | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RM062X | 6-31G | -114.404147951; Eh | |||
 | 14-Sep-2023 | /Scaling_factors H2O_(opt-freq)_-_M06-2X_6-31G_No_solvation | Nicolaou, Michael | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RM062X | 6-31G | -76.3501129398; Eh |
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