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Publications of the year 2018
  • I. Schelter, S. Kümmel
    Accurate evaluation of real-time density functional theory: Providing access to challenging electron dynamics
    J. Chem. Theory Comput., 14, 1910-1927 (2018)
    DOI: 10.1021/acs.jctc.7b01013
  • A. Löhner, R. Cogdell, J. Köhler
    Contribution of low-temperature single-molecule techniques to structural issues of pigment-protein complexes from photosynthetic purple bacteria
    J. R. Soc. Interface, 15(138), 20170680 (2018)
    DOI: 10.1098/rsif.2017.0680
  • M. Reichenberger, D. Kroh, G. M. M. Matrone, K. Schötz, S. Pröller, O. Filonik, M. E. Thordardottir, E. M. Herzig, H. Bässler, N. Stingelin, A. Köhler
    Controlling aggregate formation in conjugated polymers by spin-coating below the critical temperature of the disorder-order transition
    J. Polym. Sci. B: Polymer Phys., 56, 532-542 (2018)
    DOI: 10.1002/polb.24562
  • L. Kronik, S. Kümmel
    Dielectric screening meets optimally tuned density functionals
    Adv. Mater., 30, 1706560 (2018)
    DOI: 10.1002/adma.201706560
  • J. Lebert, E. M. Kratzer, A. Bourdick, M. Coric, S. Gekle, E. M. Herzig
    Directing the aggregation of native polythiophene during in situ polymerization
    ACS Omega, 3, 6388-6394 (2018)
    DOI: 10.1021/acsomega.8b00684
  • D. Raithel, L. Simine, S. Pickel, K. Schötz, F. Panzer, S. Baderschneider, D. Schiefer, R. Lohwasser, J. Köhler, M. Thelakkat, M. Sommer, A. Köhler, P. J. Rossky, R. Hildner
    Direct observation of backbone planarization via side-chain alignment in single bulky-substituted polythiophenes
    PNAS, 115(11), 2699-2704 (2018)
    DOI: 10.1073/pnas.1719303115
  • F.-J. Kahle, C. Saller, S. Olthof, C. Li, J. Lebert, S. Weiß, E. M. Herzig, S. Hüttner, K. Meerholz, P. Strohriegl, A. Köhler
    Does electron delocalization influence charge separation at donor-acceptor interfaces in organic photovoltaic cells
    J. Phys. Chem. C, 122, 21792-21802 (2018)
    DOI: 10.1021/acs.jpcc.8b06429
  • A. Bourdick, M. Reichenberger, A. Stradomska, G. C. Bazan, T.-Q. Nguyen, A. Köhler, S. Gekle
    Elucidating aggregation pathways in the donor-acceptor type molecules p-DTS(FBTTh2)2 and p-SIDT(FBTTh2)2
    J. Phys. Chem. B, 122, 9191-9201 (2018)
    DOI: 10.1021/acs.jpcb.8b06283
  • C. Saller, F.-J. Kahle, T. Müller, T. Hahn, S. Tscheuschner, D. Priadko, P. Strohriegl, H. Bässler, A. Köhler
    Facile method for the Investigation of Temperature-Dependent C60 Diffusion in Conjugated Polymers
    ACS Appl. Mater. Interfaces, 10(25), 21499-21509 (2018)
    DOI: 10.1021/acsami.8b05520
  • F.-J. Kahle, A. Rudnick, H. Bässler, A. Köhler
    How to interpret absorption and fluorescence spectra of charge transfer states in an organic solar cell
    Mater. Horiz., 5, 837-848 (2018)
    DOI: 10.1039/C8MH00564H
  • S. Seibt, S. With, A. Bernet, H.-W. Schmidt, S. Förster
    Hydrogelation kinetics measured in a microfluidic device with in situ X‑ray and fluorescence detection
    Langmuir, 34, 5535-5544 (2018)
    DOI: 10.1021/acs.langmuir.8b00384
  • T. Meier, T. P. Gujar, A. Schönleber, S. Olthof, K. Meerholz, S. van Smaalen, F. Panzer, M. Thelakkat, A. Köhler
    Impact of excess PbI2 on the structure and the temperature dependent optical properties of methylammonium lead iodide perovskites
    J. Mater. Chem. C, 6, 7512-7519 (2018)
    DOI: 10.1039/C8TC02237B
  • J. M. Foerster, I. Poehner, G. M. Ullmann
    MCMap—A computational tool for mapping energy landscapes of transient protein–protein interactions
    ACS Omega, 3(6), 6465-6475 (2018)
    DOI: 10.1021/acsomega.8b00572
  • A. V. Naumov, A. A. Gorshelev, M. G. Gladush, T. A. Anikushina, A. V. Golovanova, J. Köhler, L. Kador
    Micro-refractometry and local-field mapping with single molecules
    Nano Lett., 18, 6129-6134 (2018)
    DOI: 10.1021/acs.nanolett.8b01753
  • J. Garhammer, F. Hofmann, R. Armiento, S. Kümmel
    On the challenge to improve the density response with unusual gradient approximations?
    Eur. Phys. J. B, 91:159. (2018)
    DOI: 10.1140/epjb/e2018-90119-4
  • F.-J. Kahle, T. Hahn, T. Mukhopadhyav, B. Puttaraju, S. Patil, A. Köhler
    Organic bidirectional phototransistors based on diketopyrrolopyrrole and fullerene
    Adv. Funct. Mater., 1805684 (2018)
    DOI: 10.1002/adfm.201805684
  • C. Schörner, S. Motamen, L. Simon, G. Reiter, R. Hildner
    Self-Interference of exciton emission in organic single crystals visualized by engergy-momentum spectroscopy
    ACS Omega, 3, 6728-6736 (2018)
    DOI: 10.1021/acsomega.8b00811
  • M. Buchhorn, S. Wedler, F. Panzer
    Setup to study the in situ evolution of both photoluminescence and absorption during the processing of organic or hybrid semiconductors
    J. Phys. Chem. A, 122, 9115-9122 (2018)
    DOI: 10.1021/acs.jpca.8b07495
  • C. Lochenie, K. Schötz, F. Panzer, H. Kurz, B. Maier, F. Puchtler, S. Agarwal, A. Köhler, B. Weber
    Spin-Crossover Iron(II) Coordination Polymer with Fluorescent Properties: Correlation between Emission Properties and Spin State
    J. Am. Chem. Soc., 140, 700-709 (2018)
    DOI: 10.1021/jacs.7b10571
  • M. Marcus, J. D. Milward, A. Köhler, W. Barford
    Structural information for conjugated polymers from optical modeling
    J. Phys. Chem. A, 122, 3621-3625 (2018)
    DOI: 10.1021/acs.jpca.8b01585
  • L. M. Günther, A. Löhner, C. Reiher, T. Kunsel, T. L. C. Jansen, M. Tank, D. A. Bryant, J. Knoester, J. Köhler
    Structural variations in chlorosomes from wild-type and a bchQR mutant of Chlorobaculum tepidum revealed by single-molecule spectroscopy
    J. Phys. Chem B, 122, 6712-6723 (2018)
    DOI: 10.1021/acs.jpcb.8b02875
  • T. P. Gujar, T. Unger, A. Schönleber, M. Fried, F. Panzer, S. van Smaalen, A. Köhler, M. Thelakkat
    The role of PbI2 in CH3NH3PbI3 perovskite stability, solar cell parameters and device degradation
    Phys. Chem. Chem. Phys., 20, 605-614 (2018)
    DOI: 10.1039/C7CP04749E
  • K. Wilma, C.-C. Shu, U. Scherf, R. Hildner
    Visualizing hidden ultrafast processes in individual molecules by single-pulse coherent control
    J. Am. Chem. Soc., 140(45), 15329-15335 (2018)
    DOI: 10.1021/jacs.8b08674

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