Zobrazeno 1 - 5
of 5
pro vyhledávání: '"Klamroth, Tillmann (apl Prof. Dr.)"'
Autor:
Witzorky, Christoph, Paramonov, Guennaddi (Dr.), Bouakline, Foudhil (Dr.), Jaquet, Ralph, Saalfrank, Peter (Prof. Dr.), Klamroth, Tillmann (apl. Prof. Dr.)
The response of the hydrogen molecular ion, H-2(+), to few-cycle laser pulses of different intensities is simulated. To treat the coupled electron-nuclear motion, we use adiabatic potentials computed with Gaussian-type basis sets together with a heur
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=od_______266::a0c5edd593a6f2b3cf89cc9d133e7d5f
https://publishup.uni-potsdam.de/frontdoor/index/index/docId/59921
https://publishup.uni-potsdam.de/frontdoor/index/index/docId/59921
With recent experimental advances in laser-driven electron dynamics in polyatomic molecules, the need arises for their reliable theoretical modelling. Among efficient, yet fairly accurate methods for many-electron dynamics are Time-Dependent Configur
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=od_______266::565dc4ab53b91bf60fd7abc2d123aff7
https://publishup.uni-potsdam.de/frontdoor/index/index/docId/56943
https://publishup.uni-potsdam.de/frontdoor/index/index/docId/56943
Autor:
Gaebel, Tina, Bein, Daniel, Mathauer, Daniel, Utecht, Manuel, Palmer, Richard E., Klamroth, Tillmann (apl. Prof. Dr.)
We use quantum chemical cluster models together with constrained density STM Ph CI functional theory (DFT) and ab initio molecular dynamics (AIMD) for open system to simulate tip and rationalize nonlocal scanning tunneling microscope (STM) manipulati
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=od_______266::048ff4a99b3542ddfa9021d1efb2bd9b
https://publishup.uni-potsdam.de/frontdoor/index/index/docId/59708
https://publishup.uni-potsdam.de/frontdoor/index/index/docId/59708
We use clusters for the modeling of local ion resonances caused by low energy charge carriers in STM-induced desorption of benzene derivates from Si(111)-7 x 7. We perform Born-Oppenheimer molecular dynamics for the charged systems assuming vertical
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=od_______266::c9be92127d94b7902674386a1394250e
https://publishup.uni-potsdam.de/frontdoor/index/index/docId/51174
https://publishup.uni-potsdam.de/frontdoor/index/index/docId/51174
We present a cluster model to describe the localization of hot charge carriers on the Si(111)-7 x 7 surface, which leads to (nonlocal) desorption of chlorobenzene molecules in scanning tunneling microscope (STM) manipulation experiments. The localize
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=od_______266::cf30b359dc9d3a3e8f35740963ffce8f
https://publishup.uni-potsdam.de/frontdoor/index/index/docId/54778
https://publishup.uni-potsdam.de/frontdoor/index/index/docId/54778