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. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 16-Jun-2023 | /GSH GSH-H_tt_344_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -1406.25807944; Eh | |||
 | 16-Jun-2023 | /GSH GSH-H_tt_347_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -1406.24485363; Eh | |||
 | 16-Jun-2023 | /GSH GSH-H_tt_337_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -1406.24906658; Eh | |||
 | 16-Jun-2023 | /GSH GSH-H_tt_334_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -1406.24649543; Eh | |||
 | 16-Jun-2023 | /GSH GSH-H_tt_335_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -1406.25073082; Eh | |||
 | 16-Jun-2023 | /GSH GSH-H_tt_336_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -1406.25407623; Eh | |||
 | 16-Jun-2023 | /GSH GSH-H_tt_338_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -1406.25419722; Eh | |||
 | 16-Jun-2023 | /GSH GSH-H_tt_341_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -1406.25035527; Eh | |||
 | 16-Jun-2023 | /GSH GSH-H_tt_342_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -1406.25242286; Eh | |||
 | 16-Jun-2023 | /GSH GSH-H_tt_340_OptFreq | Haack, Alexander | Orca; 5.0.2; RELEASE | Geometry optimization Minimum | - | def2-TZVPP | -1406.24898180; Eh |
Results 3911-3920 of 3920 (Search time: 0.004 seconds).
Discover
Subject
- 2069 Mass spectrometry
- 2058 Conformation analysis
- 2058 Peptides
- 279 collision cross section
- 279 high-field mobility
- 279 ion mobility
- 279 MobCal
- 279 trajectory method
- 279 two-temperature theory
- 220 cannabinoid
- next >
Calculation type
- 26 Single point