| title: | Comparison of inner-shell electron binding energies and valence-electron ionization energies with each other and proton affinities of molecules |
|---|---|
| reg no: | ETF5379 |
| project type: | Estonian Science Foundation research grant |
| subject: |
1.1-1.5. Exact Sciences 1.6-1.9. Chemistry and Molecular Biology |
| status: | accepted |
| institution: | TU Faculty of Physics and Chemistry |
| head of project: | Uldo Mölder |
| duration: | 01.01.2003 - 31.12.2006 |
| description: | The major goal of the present proposal is the theoretical study of empirically established relationship between valence and inner-shell electron binding energies in organic and inorganic molecules using modern quantum chemical methods. Another goal of this work is the theoretical and experimental comparision of these quantities with proton affinities of different molecules. |
| project group | ||||
|---|---|---|---|---|
| no | name | institution | position | |
| 1. | Sergei Jurtšenko | Tartu University | Ph.D. stud. | |
| 2. | Uldo Mölder | TU Faculty of Physics and Chemistry | associate prof. | |