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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 20-Feb-2023 | SP1_crystal_md8 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -258.56282260992; Eh | |||
 | 20-Feb-2023 | SP1_crystal_md4 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -258.5607864672; Eh | |||
 | 20-Feb-2023 | SP1_crystal_md6 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -258.53828754432; Eh | |||
 | 20-Feb-2023 | SP1_crystal_md5 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -258.56174135232; Eh | |||
 | 20-Feb-2023 | SP1_crystal_md3 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -258.59683401792; Eh | |||
 | 21-Feb-2023 | SP1_crystal_md0 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -258.52869343488; Eh | |||
 | 20-Feb-2023 | SP2_crystal_EET | Curti, Mariano | Gaussian; 16; ES64L-G16RevB.01 | Excitation energy transfer | RCAM-B3LYP; TD-FC | 6-31G(D) | -2148.0089105; Eh | |||
 | 20-Feb-2023 | SP3_design_EET | Curti, Mariano | Gaussian; 16; ES64L-G16RevB.01 | Excitation energy transfer | RCAM-B3LYP; TD-FC | 6-31G(D) | -2148.0244312; Eh | |||
 | 20-Feb-2023 | SP2_design_EET | Curti, Mariano | Gaussian; 16; ES64L-G16RevB.01 | Excitation energy transfer | RCAM-B3LYP; TD-FC | 6-31G(D) | -2148.0329476; Eh | |||
 | 20-Feb-2023 | SP1_crystal_EET | Curti, Mariano | Gaussian; 16; ES64L-G16RevB.01 | Excitation energy transfer | RCAM-B3LYP; TD-FC | 6-31G(D) | -2148.0267509; Eh |
Results 31-40 of 44 (Search time: 0.001 seconds).