Stefan Prager

Stefan Prager

Ruprecht Karls Universität Heidelberg - Heidelberg / Germany
Natural Sciences / Chemical Sciences
AD Scientific Index ID: 4478764
Heidelberg University
person_outline Stefan Prager's MOST POPULAR ARTICLES
1-) Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 packageE Epifanovsky, ATB Gilbert, X Feng, J Lee, Y Mao, N Mardirossian, ...The Journal of chemical physics 155 (8), 084801, 20212282021
2-) Gold (I) complexes of tetrathiaheterohelicene phosphanesS Cauteruccio, A Loos, A Bossi, MC Blanco Jaimes, D Dova, F Rominger, ...Inorganic Chemistry 52 (14), 7995-8004, 2013672013
3-) Ultrafast CSpiro–O Dissociation via a Conical Intersection Drives Spiropyran to Merocyanine PhotoswitchingS Prager, I Burghardt, A DreuwThe Journal of Physical Chemistry A 118 (8), 1339-1349, 2014532014
4-) First time combination of frozen density embedding theory with the algebraic diagrammatic construction scheme for the polarization propagator of second orderS Prager, A Zech, F Aquilante, A Dreuw, TA WesolowskiThe Journal of chemical physics 144 (20), 2016392016
5-) Benchmark of excitation energy shifts from frozen-density embedding theory: introduction of a density-overlap-based applicability thresholdA Zech, N Ricardi, S Prager, A Dreuw, TA WesolowskiJournal of chemical theory and computation 14 (8), 4028-4040, 2018242018