검색결과 : 3건
| No. | Article |
|---|---|
| 1 |
A combined computational and experimental study of the hydrogen-bonded dimers of xanthine and hypoxanthine Hupp T, Sturm C, Janke EMB, Cabre MP, Weisz K, Engels B Journal of Physical Chemistry A, 109(8), 1703, 2005 |
| 2 |
Advantages and limitations of Kohn-Sham orbitals as single electron basis for multireference configuration interaction and multireference perturbation theory Hupp T, Engels B, Gorling A Journal of Chemical Physics, 119(22), 11591, 2003 |
| 3 |
Orbitals from a self-interaction free Kohn-Sham potential as a single electron basis for ab initio methods Hupp T, Engels B, Della Sala F, Gorling A Chemical Physics Letters, 360(1-2), 175, 2002 |