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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 19-Jun-2023 | /YGG YGG-H_cc_151_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization | - | def2-TZVPP | -1047.11509675; Eh | |||
 | 19-Jun-2023 | /YGG YGG-H_ct_009_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization | - | def2-TZVPP | -1047.09279396; Eh | |||
 | 16-Jun-2023 | /GSH GSH-H_cc_192_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization | - | def2-TZVPP | -1406.20459991; Eh | |||
 | 16-Jun-2023 | /GSH GSH-H_cc_204_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization | - | def2-TZVPP | -1406.20966936; Eh | |||
 | 19-Jun-2023 | /AAA AAA-H_tt_005_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization | - | def2-TZVPP | -819.35212756; Eh | |||
 | 16-Jun-2023 | /GSH GSH-H_cc_265_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization | - | def2-TZVPP | -1406.22587678; Eh | |||
 | 16-Jun-2023 | /GSH GSH-H_ct_123_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization | - | def2-TZVPP | -1406.23241319; Eh | |||
 | 16-Jun-2023 | /GSH GSH-H_ct_172_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization | - | def2-TZVPP | -1406.25826613; Eh | |||
 | 16-Jun-2023 | /GSH GSH-H_cc_037_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization | - | def2-TZVPP | -1406.19445698; Eh | |||
 | 16-Jun-2023 | /GSH GSH-H_tt_300_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization | - | def2-TZVPP | -1406.25516135; Eh |
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