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Item hits:
Preview | Title | Author(s) | Program | Method(s) | Basis Set | Energy | Solv. | Vibr. |
---|---|---|---|---|---|---|---|---|
NMMP_rigid_scan | Novotny, Jan | Orca; 5.0.4; RELEASE | DFT | def2-TZVPP | -326.35531444; Eh |
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Total items:
Preview | Title | Author(s) | Program | Method(s) | Basis Set | Energy | Solv. | Vibr. |
---|---|---|---|---|---|---|---|---|
NMMP_rigid_scan | Novotny, Jan | Orca; 5.0.4; RELEASE | DFT | def2-TZVPP | -326.35531444; Eh |
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