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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 15-Mar-2023 | delta9_THC_1 | Ieritano, Christian | Orca; 5.0.3; RELEASE | Single point | DLPNO-CCSD(T) | def2-TZVPP; def2-TZVPP/C | -962.78125180; Eh | |||
 | 15-Mar-2023 | delta9_THC_405 | Ieritano, Christian | Orca; 5.0.3; RELEASE | Single point | DLPNO-CCSD(T) | def2-TZVPP; def2-TZVPP/C | -962.77261317; Eh | |||
 | 15-Mar-2023 | CBC_3058 | Ieritano, Christian | Orca; 5.0.3; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -968.82614589; Eh | |||
 | 15-Mar-2023 | CBC_758 | Ieritano, Christian | Orca; 5.0.3; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -968.82562299; Eh | |||
 | 15-Mar-2023 | CBC_7 | Ieritano, Christian | Orca; 5.0.3; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -968.82618873; Eh | |||
 | 15-Mar-2023 | CBC_31 | Ieritano, Christian | Orca; 5.0.3; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -968.82700924; Eh | |||
 | 15-Mar-2023 | CBC_307 | Ieritano, Christian | Orca; 5.0.3; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -968.82601402; Eh | |||
 | 15-Mar-2023 | CBC_785 | Ieritano, Christian | Orca; 5.0.3; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -968.82286611; Eh | |||
 | 15-Mar-2023 | CBC_644 | Ieritano, Christian | Orca; 5.0.3; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -968.82564320; Eh | |||
 | 15-Mar-2023 | CBD_277 | Ieritano, Christian | Orca; 5.0.3; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -968.83176597; Eh |
Results 441-450 of 473 (Search time: 0.001 seconds).
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- 473 cannabinoid
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- 238 DLPNO-CCSD(T)