Search
Add filters:
Use filters to refine the search results.
Item hits:
Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
---|---|---|---|---|---|---|---|---|---|---|---|
17-Nov-2021 | /Aniline_Clusters/MeOH_Clusters Aniline_MeOH_4f | Haack, Alexander | Orca; 5.0.1; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -751.03651898; Eh | ||||
17-Nov-2021 | /Aniline_Clusters/MeOH_Clusters Aniline_MeOH_4e | Haack, Alexander | Orca; 5.0.1; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -751.03300278; Eh | ||||
17-Nov-2021 | /Aniline_Clusters/MeOH_Clusters Aniline_MeOH_4g | Haack, Alexander | Orca; 5.0.1; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -751.02487027; Eh | ||||
17-Nov-2021 | /Aniline_Clusters/MeOH_Clusters Aniline_MeOH_4d | Haack, Alexander | Orca; 5.0.1; RELEASE | Geometry optimization | - | def2-TZVPP | -751.03186962; Eh |
Results 221-224 of 224 (Search time: 0.001 seconds).
Discover
Calculation type