Items where contributor is "von Rudorff, Guido Falk"
2020von Rudorff, Guido Falk and von Lilienfeld, O. Anatole. (2020) Rapid and accurate molecular deprotonation energies from quantum alchemy. Physical Chemistry Chemical Physics, 22 (19). 10519 -10525 . 2018von Rudorff, Guido Falk and von Lilienfeld, O. Anatole. (2018) Alchemical perturbation density functional theory. Chemical physics. pp. 1-6. |