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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 29-Sep-2025 | 1a_MD_Initialization | Hölter, Niklas | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RM062X | 6-311++G(D,P) | -654.131256754; Eh | |||
 | 29-Sep-2025 | 2av_MD_Initialization | Hölter, Niklas | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RM062X | 6-311++G(D,P) | -764.575414882; Eh | |||
 | 29-Sep-2025 | III_MD_initialization | Hölter, Niklas | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RM062X | 6-311++G(D,P) | -764.607134455; Eh |
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