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Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
---|---|---|---|---|---|---|---|---|---|---|---|
![]() | 31-Mar-2025 | Hept_100 | Sarfraz, Iqra | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RB3LYP; RwB97XD | DEF2SVP DEF2TZVPP | -1154.0925965; Eh | |||
![]() | 31-Mar-2025 | Hept_71 | Sarfraz, Iqra | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RB3LYP; RwB97XD | DEF2SVP DEF2TZVPP | -1154.0829884; Eh | |||
![]() | 31-Mar-2025 | Hept_74 | Sarfraz, Iqra | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RB3LYP; RwB97XD | DEF2SVP DEF2TZVPP | -1154.0864664; Eh | |||
![]() | 31-Mar-2025 | Hept_78 | Sarfraz, Iqra | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RB3LYP; RwB97XD | DEF2SVP DEF2TZVPP | -1154.0927881; Eh | |||
![]() | 31-Mar-2025 | Hept_64 | Sarfraz, Iqra | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RB3LYP; RwB97XD | DEF2SVP DEF2TZVPP | -1154.0691072; Eh | |||
![]() | 31-Mar-2025 | Hept_18 | Sarfraz, Iqra | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RB3LYP; RwB97XD | DEF2SVP DEF2TZVPP | -1154.0848784; Eh | |||
![]() | 31-Mar-2025 | Hept_58 | Sarfraz, Iqra | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RB3LYP; RwB97XD | DEF2SVP DEF2TZVPP | -1154.070515; Eh | |||
![]() | 31-Mar-2025 | Hept_22 | Sarfraz, Iqra | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RB3LYP; RwB97XD | DEF2SVP DEF2TZVPP | -1154.0731443; Eh | |||
![]() | 31-Mar-2025 | Hept_01 | Sarfraz, Iqra | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RB3LYP; RwB97XD | DEF2SVP DEF2TZVPP | -1154.0683903; Eh | |||
![]() | 31-Mar-2025 | Hept_87 | Sarfraz, Iqra | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RB3LYP; RwB97XD | DEF2SVP DEF2TZVPP | -1154.0850403; Eh |
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