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. |
---|---|---|---|---|---|---|---|---|---|---|---|
7-May-2024 | /Methanol/Opt-freq L | Zlatar, Matija | AMS; 2023.104; r115785 | Frequencies | BP86 | - | -208.447913; eV | ||||
7-May-2024 | /Water/Opt-freq Water | Zlatar, Matija | AMS; 2023.104; r115785 | Frequencies | BP86 | - | -14.307019; eV | ||||
7-May-2024 | /DMSO/Opt-freq Azide | Zlatar, Matija | AMS; 2023.104; r115785 | Frequencies | BP86 | - | -26.664946; eV | ||||
7-May-2024 | /DMSO/Opt-freq Zn-L-2DMSO | Zlatar, Matija | AMS; 2023.104; r115785 | Frequencies | BP86 | - | -303.274610; eV | ||||
7-May-2024 | /Methanol/Opt-freq Zn-2L | Zlatar, Matija | AMS; 2023.104; r115785 | Frequencies | BP86 | - | -413.171234; eV | ||||
7-May-2024 | /DMSO/Opt-freq L | Zlatar, Matija | AMS; 2023.104; r115785 | Frequencies | BP86 | - | -208.412461; eV | ||||
7-May-2024 | /Methanol/Opt-freq Zn-L-2MeOH | Zlatar, Matija | AMS; 2023.104; r115785 | Frequencies | BP86 | - | -263.194742; eV | ||||
7-May-2024 | /Methanol/Opt-freq Zn-L-2OCN | Zlatar, Matija | AMS; 2023.104; r115785 | Frequencies | BP86 | - | -258.565026; eV | ||||
7-May-2024 | /Water/Opt-freq Zn-L-2OCN | Zlatar, Matija | AMS; 2023.104; r115785 | Frequencies | BP86 | - | -258.694600; eV | ||||
7-May-2024 | /DMSO/Opt-freq Zn-2L | Zlatar, Matija | AMS; 2023.104; r115785 | Frequencies | BP86 | - | -413.144450; eV |
Results 1-10 of 32 (Search time: 0.0 seconds).