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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 15-Mar-2023 | Delta8_THC_Ag_Iso3_18 | Ieritano, Christian | Orca; 5.0.3; RELEASE | Single point | DLPNO-CCSD(T) | def2-TZVPP; def2-TZVPP/C | -1108.71463799; Eh | |||
 | 15-Mar-2023 | Delta8_THC_Ag_Iso2_5 | Ieritano, Christian | Orca; 5.0.3; RELEASE | Single point | DLPNO-CCSD(T) | def2-TZVPP; def2-TZVPP/C | -1108.71147095; Eh | |||
 | 15-Mar-2023 | Delta8_THC_Ag_Iso2_1 | Ieritano, Christian | Orca; 5.0.3; RELEASE | Single point | DLPNO-CCSD(T) | def2-TZVPP; def2-TZVPP/C | -1108.71424672; Eh | |||
 | 15-Mar-2023 | Delta8_THC_Ag_Iso2_2 | Ieritano, Christian | Orca; 5.0.3; RELEASE | Single point | DLPNO-CCSD(T) | def2-TZVPP; def2-TZVPP/C | -1108.71546032; Eh | |||
 | 15-Mar-2023 | Delta8_THC_Ag_Iso2_4 | Ieritano, Christian | Orca; 5.0.3; RELEASE | Single point | DLPNO-CCSD(T) | def2-TZVPP; def2-TZVPP/C | -1108.71073776; Eh | |||
 | 15-Mar-2023 | Delta9_THC_Ag_Iso1_113 | Ieritano, Christian | Orca; 5.0.2; RELEASE | Single point | DLPNO-CCSD(T) | def2-TZVPP; def2-TZVPP/C | -1108.70615862; Eh | |||
 | 15-Mar-2023 | Delta9_THC_Ag_Iso1_120 | Ieritano, Christian | Orca; 5.0.2; RELEASE | Single point | DLPNO-CCSD(T) | def2-TZVPP; def2-TZVPP/C | -1108.70357204; Eh | |||
 | 15-Mar-2023 | Delta9_THC_Ag_Iso1_109 | Ieritano, Christian | Orca; 5.0.2; RELEASE | Single point | DLPNO-CCSD(T) | def2-TZVPP; def2-TZVPP/C | -1108.71224380; Eh | |||
 | 15-Mar-2023 | Delta9_THC_Ag_Iso1_12 | Ieritano, Christian | Orca; 5.0.2; RELEASE | Single point | DLPNO-CCSD(T) | def2-TZVPP; def2-TZVPP/C | -1108.71459616; Eh | |||
 | 15-Mar-2023 | Delta9_THC_Ag_Iso1_119 | Ieritano, Christian | Orca; 5.0.2; RELEASE | Single point | DLPNO-CCSD(T) | def2-TZVPP; def2-TZVPP/C | -1108.71159404; Eh |
Results 41-50 of 238 (Search time: 0.002 seconds).