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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 12-Mar-2026 | TS2b | Li, Yingzi | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | DEF2TZVP | -6627.6068522; Eh | |||
 | 12-Mar-2026 | int1b | Li, Yingzi | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | DEF2TZVP | -6088.3161191; Eh | |||
 | 12-Mar-2026 | Anthraquinone1 | Li, Yingzi | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | DEF2TZVP | -688.541984; Eh | |||
 | 12-Mar-2026 | Anthraquinone2 | Li, Yingzi | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | DEF2TZVP | -688.5441673; Eh | |||
 | 12-Mar-2026 | Anthracene2 | Li, Yingzi | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | DEF2TZVP | -539.3005036; Eh | |||
 | 12-Mar-2026 | ZnCl2a | Li, Yingzi | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | DEF2TZVP | -2699.8648237; Eh | |||
 | 12-Mar-2026 | TS1a | Li, Yingzi | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | DEF2TZVP | -1227.8102812; Eh | |||
 | 12-Mar-2026 | TS1b | Li, Yingzi | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | DEF2TZVP | -1227.8135634; Eh | |||
 | 12-Mar-2026 | Anthracene | Li, Yingzi | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | DEF2TZVP | -539.2828776; Eh | |||
 | 12-Mar-2026 | int1_DCM | Li, Yingzi | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | DEF2TZVP | -8007.7037595; Eh |
Results 12931-12940 of 12948 (Search time: 0.321 seconds).
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- 748 Reaction mechanisms
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- 529 Copper
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- 294 Imine Condensation
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