1. University of Copenhagen

Search        

Start a new search
Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg13-Aug-2025/dft_calculations/electrostatic_field/strong_field moved_-2_0Bro-Jørgensen, William-Single pointDFTdef2-SVP-989.5292207465; Eh
thumbnail.jpeg13-Aug-2025/dft_calculations/electrostatic_field/weak_field moved_-1_85Bro-Jørgensen, William-Single pointDFTdef2-SVP-989.5207233843; Eh
thumbnail.jpeg13-Aug-2025/dft_calculations/electrostatic_field/weak_field moved_-1_41Bro-Jørgensen, William-Single pointDFTdef2-SVP-989.5227027831; Eh
thumbnail.jpeg13-Aug-2025/dft_calculations/electrostatic_field/no_field moved_0_0588Bro-Jørgensen, William-Single pointDFTdef2-SVP-989.5334223860; Eh
thumbnail.jpeg13-Aug-2025/dft_calculations/electrostatic_field/weak_field moved_0_5Bro-Jørgensen, William-Single pointDFTdef2-SVP-989.5156130885; Eh
thumbnail.jpeg13-Aug-2025/dft_calculations/gibbs_free_energy BSSE_bipyridinesBro-Jørgensen, William-Single pointDFT--990.7245971772; Eh
thumbnail.jpeg13-Aug-2025/dft_calculations/electrostatic_field/no_field moved_-1_71Bro-Jørgensen, William-Single pointDFTdef2-SVP-989.5183006304; Eh
thumbnail.jpeg13-Aug-2025/dft_calculations/electrostatic_field/no_field moved_-1_26Bro-Jørgensen, William-Single pointDFTdef2-SVP-989.5207334110; Eh
thumbnail.jpeg13-Aug-2025/dft_calculations/m062x double-bpyBro-Jørgensen, William-Geometry optimization TSDFTdef2-TZVPPD-990.7248893047; Eh
thumbnail.jpeg13-Aug-2025/dft_calculations/electrostatic_field/no_field moved_-1_12Bro-Jørgensen, William-Single pointDFTdef2-SVP-989.5218672581; Eh
Results 331-340 of 340 (Search time: 0.004 seconds).

Discover