@article{KramerLaeuter2019, author = {Kramer, Tobias and L{\"a}uter, Matthias}, title = {Outgassing induced acceleration of comet 67P/Churyumov-Gerasimenko}, volume = {630}, journal = {Astronomy \& Astrophysics}, arxiv = {http://arxiv.org/abs/1902.02701}, doi = {10.1051/0004-6361/201935229}, pages = {A4}, year = {2019}, abstract = {Cometary activity affects the orbital motion and rotation state due to sublimation induced forces. The availability of precise rotation-axis orientation and position data from the Rosetta mission allows one to accurately determine the outgassing of comet Churyumov-Gerasimenko/67P (67P). We derive the observed non-gravitational acceleration of 67P directly from the Rosetta spacecraft trajectory. From the non-gravitational acceleration we recover the diurnal outgassing variations and study a possible delay of the sublimation response with respect to the peak solar illumination. This allows us to compare the non-gravitational acceleration of 67P with expectations based on empirical models and common assumptions about the sublimation process. We use an iterative orbit refinement and Fourier decomposition of the diurnal activity to derive the outgassing induced non-gravitational acceleration. The uncertainties of the data reduction are established by a sensitivity analysis of an ensemble of best-fit orbits for comet 67P. We find that the Marsden non-gravitational acceleration parameters reproduce part of the non-gravitational acceleration but need to be augmented by an analysis of the nucleus geometry and surface illumination to draw conclusions about the sublimation process on the surface. The non-gravitational acceleration follows closely the subsolar latitude (seasonal illumination), with a small lag angle with respect to local noon around perihelion. The observed minor changes of the rotation axis do not favor forced precession models for the non-gravitational acceleration. In contrast to the sublimation induced torques, the non-gravitational acceleration does not put strong constraints on localized active areas on the nucleus. We find a close agreement of the orbit deduced non-gravitational acceleration and the water production independently derived from Rosetta in-situ measurement.}, language = {en} } @article{RodriguezKramer2019, author = {Rodr{\´i}guez, Mirta and Kramer, Tobias}, title = {Machine Learning of Two-Dimensional Spectroscopic Data}, volume = {520}, journal = {Chemical Physics}, arxiv = {http://arxiv.org/abs/1810.01124}, doi = {10.1016/j.chemphys.2019.01.002}, pages = {52 -- 60}, year = {2019}, abstract = {Two-dimensional electronic spectroscopy has become one of the main experimental tools for analyzing the dynamics of excitonic energy transfer in large molecular complexes. Simplified theoretical models are usually employed to extract model parameters from the experimental spectral data. Here we show that computationally expensive but exact theoretical methods encoded into a neural network can be used to extract model parameters and infer structural information such as dipole orientation from two dimensional electronic spectra (2DES) or reversely, to produce 2DES from model parameters. We propose to use machine learning as a tool to predict unknown parameters in the models underlying recorded spectra and as a way to encode computationally expensive numerical methods into efficient prediction tools. We showcase the use of a trained neural network to efficiently compute disordered averaged spectra and demonstrate that disorder averaging has non-trivial effects for polarization controlled 2DES.}, language = {en} } @article{KramerLaeuterHviidetal.2019, author = {Kramer, Tobias and L{\"a}uter, Matthias and Hviid, Stubbe and Jorda, Laurent and Keller, Horst Uwe and K{\"u}hrt, Ekkehard}, title = {Comet 67P/Churyumov-Gerasimenko rotation changes derived from sublimation induced torques}, volume = {630}, journal = {Astronomy \& Astrophysics}, arxiv = {http://arxiv.org/abs/1812.01490}, doi = {10.1051/0004-6361/201834349}, pages = {A3}, year = {2019}, abstract = {Context. The change of the rotation period and the orientation of the rotation axis of comet 67P/Churyumov-Gerasimenko (67P/C-G) is deducible from images taken by the scientific imaging instruments on-board the Rosetta mission with high precision. Non gravitational forces are a natural explanation for these data. Aims. We describe observed changes for the orientation of the rotation axis and the rotation period of 67P/C-G. For these changes we give an explanation based on a sublimation model with a best-fit for the surface active fraction (model P). Torque effects of periodically changing gas emissions on the surface are considered. Methods. We solve the equation of state for the angular momentum in the inertial and the body- fixed frames and provide an analytic theory of the rotation changes in terms of Fourier coefficients, generally applicable to periodically forced rigid body dynamics. Results. The torque induced changes of the rotation state constrain the physical properties of the surface, the sublimation rate and the local active fraction of the surface. Conclusions. We determine a distribution of the local surface active fraction in agreement with the rotation properties, period and orientation, of 67P/C-G. The torque movement confirms that the sublimation increases faster than the insolation towards perihelion. The derived relatively uniform activity pattern is discussed in terms of related surface features.}, language = {en} } @article{LaeuterKramerRubinetal.2019, author = {L{\"a}uter, Matthias and Kramer, Tobias and Rubin, Martin and Altwegg, Kathrin}, title = {Surface localization of gas sources on comet 67P/Churyumov-Gerasimenko based on DFMS/COPS data}, volume = {483}, journal = {Monthly Notices of the Royal Astronomical Society}, publisher = {Monthly Notices of the Royal Astronomical Society}, arxiv = {http://arxiv.org/abs/1804.06696}, doi = {10.1093/mnras/sty3103}, pages = {852 -- 861}, year = {2019}, abstract = {We reconstruct the temporal evolution of the source distribution for the four major gas species H2O, CO2, CO, and O2 on the surface of comet 67P/Churyumov-Gerasimenko during its 2015 apparition. The analysis applies an inverse coma model and fits to data between August 6th 2014 and September 5th 2016 measured with the Double Focusing Mass Spectrometer (DFMS) of the Rosetta Orbiter Spectrometer for Ion and Neutral Analysis (ROSINA) and the COmet Pressure Sensor (COPS). The spatial distribution of gas sources with their temporal variation allows one to construct surface maps for gas emissions and to evaluate integrated productions rates. For all species peak production rates and integrated productions rates per orbit are evaluated separately for the northern and the southern hemisphere. The nine most active emitting areas on the comet's surface are defined and their correlation to emissions for each of the species is discussed.}, language = {en} } @article{KreisbeckKramerMolina2017, author = {Kreisbeck, Christoph and Kramer, Tobias and Molina, Rafael}, title = {Time-dependent wave packet simulations of transport through Aharanov-Bohm rings with an embedded quantum dot}, volume = {29}, journal = {Journal of Physics: Condensed Matter}, number = {15}, doi = {10.1088/1361-648X/aa605d}, pages = {155301}, year = {2017}, abstract = {We have performed time-dependent wave packet simulations of realistic Aharonov-Bohm (AB) devices with a quantum dot embedded in one of the arms of the interferometer. The AB ring can function as a measurement device for the intrinsic transmission phase through the quantum dot, however, care has to be taken in analyzing the influence of scattering processes in the junctions of the interferometer arms. We consider a harmonic quantum dot and show how the Darwin-Fock spectrum emerges as a unique pattern in the interference fringes of the AB oscillations.}, language = {en} } @article{KramerRodriguezZelinskyi2017, author = {Kramer, Tobias and Rodriguez, Mirta and Zelinskyi, Yaroslav}, title = {Modeling of Transient Absorption Spectra in Exciton Charge-Transfer Systems}, volume = {121}, journal = {Journal of Physical Chemistry B}, arxiv = {http://arxiv.org/abs/1811.10683}, doi = {10.1021/acs.jpcb.6b09858}, pages = {463 -- 470}, year = {2017}, abstract = {Time-resolved spectroscopy provides the main tool for analyzing the dynamics of excitonic energy transfer in light-harvesting complexes. To infer time-scales and effective coupling parameters from experimental data requires to develop numerical exact theoretical models. The finite duration of the laser-molecule interactions and the reorganization process during the exciton migration affect the location and strength of spectroscopic signals. We show that the non-perturbative hierarchical equations of motion (HEOM) method captures these processes in a model exciton system, including the charge transfer state.}, language = {en} } @article{KramerNoack2016, author = {Kramer, Tobias and Noack, Matthias}, title = {On the origin of inner coma structures observed by Rosetta during a diurnal rotation of comet 67P/Churyumov-Gerasimenko}, volume = {823}, journal = {The Astrophysical Journal Letters}, number = {1}, doi = {10.3847/2041-8205/823/1/L11}, pages = {L11}, year = {2016}, abstract = {The Rosetta probe around comet 67P/Churyumov-Gerasimenko (67P) reveals an anisotropic dust distribution of the inner coma with jet-like structures. The physical processes leading to jet formation are under debate, with most models for cometary activity focusing on localized emission sources, such as cliffs or terraced regions. Here we suggest, by correlating high-resolution simulations of the dust environment around 67P with observations, that the anisotropy and the background dust density of 67P originate from dust released across the entire sunlit surface of the nucleus rather than from few isolated sources. We trace back trajectories from coma regions with high local dust density in space to the non-spherical nucleus and identify two mechanisms of jet formation: areas with local concavity in either two dimensions or only one. Pits and craters are examples of the first case; the neck region of the bi-lobed nucleus of 67P is an example of the latter case. The conjunction of multiple sources, in addition to dust released from all other sunlit areas, results in a high correlation coefficient (~0.8) of the predictions with observations during a complete diurnal rotation period of 67P.}, language = {en} } @article{ReimersBiczyskoBruceetal.2016, author = {Reimers, Jeffrey R. and Biczysko, Malgorzata and Bruce, Douglas and Coker, David F. and Frankcombe, Terry J. and Hashimoto, Hideki and Hauer, J{\"u}rgen and Jankowiak, Ryszard and Kramer, Tobias and Linnanto, Juha and Mamedov, Fikret and M{\"u}h, Frank and R{\"a}tsep, Margus and Renger, Thomas and Styring, Stenbj{\"o}rn and Wan, Jian and Wang, Zhuan and Wang-Otomo, Zheng-Yu and Weng, Yu-Xiang and Yang, Chunhong and Zhang, Jian-Ping and Freiberg, Arvi and Krausz, Elmars}, title = {Challenges facing an understanding of the nature of low-energy excited states in photosynthesis}, volume = {1857}, journal = {BBA Bioenergetics}, number = {9}, doi = {10.1016/j.bbabio.2016.06.010}, pages = {1627 -- 1640}, year = {2016}, abstract = {While the majority of the photochemical states and pathways related to the biological capture of solar energy are now well understood and provide paradigms for artificial device design, additional low-energy states have been discovered in many systems with obscure origins and significance. However, as low-energy states are naively expected to be critical to function, these observations pose important challenges. A review of known properties of low energy states covering eight photochemical systems, and options for their interpretation, are presented. A concerted experimental and theoretical research strategy is suggested and outlined, this being aimed at providing a fully comprehensive understanding.}, language = {en} } @article{KramerKreisbeckRihaetal.2016, author = {Kramer, Tobias and Kreisbeck, Christoph and Riha, Christian and Chiatti, Olivio and Buchholz, Sven and Wieck, Andreas and Reuter, Dirk and Fischer, Saskia}, title = {Thermal energy and charge currents in multi-terminal nanorings}, volume = {6}, journal = {AIP Advances}, doi = {10.1063/1.4953812}, pages = {065306}, year = {2016}, abstract = {We study in experiment and theory thermal energy and charge transfer close to the quantum limit in a ballistic nanodevice, consisting of multiply connected one-dimensional electron waveguides. The fabricated device is based on an AlGaAs/GaAs heterostructure and is covered by a global top-gate to steer the thermal energy and charge transfer in the presence of a temperature gradient, which is established by a heating current. The estimate of the heat transfer by means of thermal noise measurements shows the device acting as a switch for charge and thermal energy transfer. The wave-packet simulations are based on the multi-terminal Landauer-B{\"u}ttiker approach and confirm the experimental finding of a mode-dependent redistribution of the thermal energy current, if a scatterer breaks the device symmetry.}, language = {en} } @article{KramerNoackBaumetal.2015, author = {Kramer, Tobias and Noack, Matthias and Baum, Daniel and Hege, Hans-Christian and Heller, Eric J.}, title = {Homogeneous dust emission and jet structure near active cometary nuclei: the case of 67P/Churyumov-Gerasimenko}, arxiv = {http://arxiv.org/abs/1505.08041}, year = {2015}, abstract = {We compute trajectories of dust grains starting from a homogeneous surface activity-profile on a irregularly shaped cometary nucleus. Despite the initially homogeneous dust distribution a collimation in jet-like structures becomes visible. The fine structure is caused by concave topographical features with similar bundles of normal vectors. The model incorporates accurately determined gravitational forces, rotation of the nucleus, and gas-dust interaction. Jet-like dust structures are obtained for a wide range of gas-dust interactions. For the comet 67P/Churyumov-Gerasimenko, we derive the global dust distribution around the nucleus and find several areas of agreement between the homogeneous dust emission model and the Rosetta observation of dust jets, including velocity-dependent bending of trajectories.}, language = {en} }