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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 26-Jun-2024 | /DFT/Fe2_MOC_I/F_substituted HSLS_Freq | Navarro, Laia | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UTPSSh | GEN | -14168.1643165; Eh | |||
 | 26-Jun-2024 | /DFT/Fe2_MOC_I/F_substituted HSHS_Freq | Navarro, Laia | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UTPSSh | GEN | -14168.1575904; Eh | |||
 | 26-Jun-2024 | /DFT/Fe2_MOC_I/no_substituted HSLS_Freq | Navarro, Laia | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UTPSSh | GEN | -12977.0002779; Eh | |||
 | 26-Jun-2024 | /DFT/Fe2_MOC_Br/CH3_substituted HSHS_Freq | Navarro, Laia | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UTPSSh | GEN | -9103.95727035; Eh | |||
 | 26-Jun-2024 | /DFT/Fe2_MOC_I/CH3_substituted HSHS_Freq | Navarro, Laia | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UTPSSh | GEN | -13449.0009730; Eh | |||
 | 26-Jun-2024 | /DFT/Fe2_MOC_I/CH3_substituted LSLS_Freq | Navarro, Laia | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UTPSSh | GEN | -13449.0298232; Eh | |||
 | 26-Jun-2024 | /DFT/Fe2_MOC_I/no_substituted HSHS_Freq | Navarro, Laia | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UTPSSh | GEN | -12976.9899800; Eh | |||
 | 26-Jun-2024 | /DFT/Fe2_MOC_I/no_substituted LSLS_Freq | Navarro, Laia | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UTPSSh | GEN | -12977.0096354; Eh |
Results 51-58 of 58 (Search time: 0.001 seconds).