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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 9-Jan-2024 | /Rh2(s-dosp)4_system dosp_Rhcarbene_aabb_cis | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RB3LYP | GENECP | -5515.69702283; Eh | |||
 | 9-Jan-2024 | /Rh2(s-dosp)4_system dosp_cat_aaab | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RB3LYP | GENECP | -4940.05880149; Eh | |||
 | 9-Jan-2024 | /model_system TS4_H-trans-boat-out | Guo, Wentao | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RB3LYP | GENECP | -1553.80137882; Eh | |||
 | 9-Jan-2024 | /model_system TS5_H-cis-chair-out | Guo, Wentao | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RB3LYP | GENECP | -1553.81021148; Eh | |||
 | 9-Jan-2024 | /model_system TS4_H-trans-boat-in | Guo, Wentao | Gaussian; 09; AM64L-G09RevD.01 | Single point Structure | RB3LYP | GENECP | -1553.80212171; Eh | |||
 | 9-Jan-2024 | /model_system TS5_H-cis-chair-in | Guo, Wentao | Gaussian; 16; ES64L-G16RevB.01 | Geometry optimization TS | RB3LYP | GENECP | -1553.81016789; Eh | |||
 | 9-Jan-2024 | /Rh2(OAc)4_system TS2_Ph-trans | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization TS | RB3LYP | 6-31G(D) LANL2DZ GENECP | -1818.27250062; Eh | |||
 | 9-Jan-2024 | /Rh2(OAc)4_system TS2_Ph-cis | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization TS | RB3LYP | 6-31G(D) LANL2DZ GENECP | -1818.27407956; Eh | |||
 | 9-Jan-2024 | /Rh2(OAc)4_system 2_Ph-trans | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RB3LYP | 6-31G(D) LANL2DZ GENECP | -1708.77876298; Eh | |||
 | 9-Jan-2024 | /Rh2(OAc)4_system 2_Ph-cis | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RB3LYP | 6-31G(D) LANL2DZ GENECP | -1708.78022182; Eh |
Results 81-90 of 92 (Search time: 0.001 seconds).