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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 H2CO_(opt-freq)_-_BP86_6-311++G(2d,2p)_No_solvation | Nicolaou, Michael | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RBP86 | 6-311++G(2D,2P) | -114.543720861; Eh | |||
 | 14-Sep-2023 | /Scaling_factors C2H2_(opt-freq)_-_BP86_6-311++G(2d,2p)_No_solvation | Nicolaou, Michael | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RBP86 | 6-311++G(2D,2P) | -77.3512517276; Eh | |||
 | 14-Sep-2023 | /Scaling_factors Cl2_(opt-freq)_-_BP86_6-311++G(2d,2p)_No_solvation | Nicolaou, Michael | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RBP86 | 6-311++G(2D,2P) | -920.479267151; Eh | |||
 | 14-Sep-2023 | /Scaling_factors CH4_(opt-freq)_-_BP86_6-311++G(2d,2p)_No_solvation | Nicolaou, Michael | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RBP86 | 6-311++G(2D,2P) | -40.5294022109; Eh | |||
 | 14-Sep-2023 | /Scaling_factors NH3_(opt-freq)_-_BP86_6-311++G(2d,2p)_No_solvation | Nicolaou, Michael | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RBP86 | 6-311++G(2D,2P) | -56.5844871105; Eh | |||
 | 14-Sep-2023 | /Scaling_factors N2O_(opt-freq)_-_BP86_6-311++G(2d,2p)_No_solvation | Nicolaou, Michael | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RBP86 | 6-311++G(2D,2P) | -184.745489271; Eh |
Results 21-26 of 26 (Search time: 0.002 seconds).