Department Publications

Journal Article (211)

2021
Journal Article
Fundamental Flaw in the Current Construction of the TiO2 Electron Transport Layer of Perovskite Solar Cells and Its Elimination
Y. Yan, C. Liu, Y. Yang, G. Hu, V. Tiwari, D.-e. Jiang, W. Peng, A. Jha, H.-G. Duan, F. Tellkamp, Y. Ding, W. Shi, S. Yuan, R. J. D. Miller, W. Ma, J. Zhao
ACS Applied Materials and Interfaces 13 (33), 39371–39378 (2021)
Journal Article
Probing the formation and optical properties of Ti3+–TiO2 with (001) exposed crystal facet by ethanol-assisted fluorination
J. Wang, W. Lin, S. Zhou, Z. Li, H. Hu, Y. Tao, S. Zhou, X. Zhaod, Y. Kong
New Journal of Chemistry 45 (28), 12453–12463 (2021)
Journal Article
Nuclear dynamics of singlet exciton fission in pentacene single crystals
H. Seiler, M. Krynski, D. Zahn, S. Hammer, Y. W. Windsor, T. Vasileiadis, J. Pflaum, R. Ernstorfer, M. Rossi, H. Schwoerer
Science Advances 7 (26), eabg0869 (2021)
Journal Article
Serial Electron Diffraction Data Processing With diffractem and CrystFEL
R. Bücker, P. Hogan-Lamarre, R. J. D. Miller
Frontiers in Molecular Biosciences 8, 624264 (2021)
Journal Article
A simple vapor-diffusion method enables protein crystallization inside the HARE serial crystallography chip
B. Norton-Baker, P. Mehrabi, J. Boger, R. Schönherr, D. von Stetten, H. Schikora, A. O. Kwok, R. W. Martin, R. J. D. Miller, L. Redecke, E.-C. Schulz
Acta Crystallographica Section D: Structural Biology 77 (6), D77 (2021)
Journal Article
X-ray screening identifies active site and allosteric inhibitors of SARS-CoV-2 main protease
S. Günther, P. Y. A. Reinke, Y. Fernández-García, J. Lieske, T. J. Lane, H. M. Ginn, F. H. M. Koua, C. Ehrt, W. Ewert, D. Oberthuer, O. Yefanov, S. Meier, K. Lorenzen, B. Krichel, J.-D. Kopicki, L. Gelisio, W. Brehm, I. Dunkel, B. Seychell, H. Gieseler, B. Norton-Baker, B. Escudero-Pérez, M. Domaracky, S. Saouane, A. Tolstikova, T. A. White, A. Hänle, M. Groessler, H. Fleckenstein, F. Trost, M. Galchenkova, Y. Gevorkov, C. Li, S. Awel, A. Peck, M. Barthelmess, F. Schlünzen, L. X. Paulraj, N. Werner, H. Andaleeb, N. Ullah, S. Falke, V. Srinivasan, B. A. Franca, M. Schwinzer, H. Brognaro, C. Rogers, D. Melo, J. J. Zaitsev-Doyle, J. Knoska, G. E. P. Murillo, A. R. Mashhour, F. Guicking, V. Hennicke, P. Fischer, J. Hakanpää, J. Meyer, P. Gribbon, B. Ellinger, M. Kuzikov, M. Wolf, A. R. Beccari, G. Bourenkov, D. von Stetten, G. Pompidor, I. Bento, S. Panneerselvam, I. Karpics, T. R. Schneider, M. M. G. Alai, S. Niebling, C. Günther, C. Schmidt, R. Schubert, H. Han, J. Boger, D. C. F. Monteiro, L. Zhang, X. Sun, J. Pletzer-Zelgert, J. Wollenhaupt, C. G. Feiler, M. S. Weiss, E.-C. Schulz, P. Mehrabi, K. Karničar, A. Usenik, J. Loboda, H. Tidow, A. Chari, R. Hilgenfeld, C. Uetrecht, R. Cox, A. Zaliani, T. Beck, M. Rarey, S. Günther, D. Turk, W. Hinrichs, H. N. Chapman, A. .R. Pearson, C. Betzel, A. Meents
Science 372 (6542), 642–646 (2021)
Journal Article
Serial femtosecond and serial synchrotron crystallography can yield data of equivalent quality: A systematic comparison
P. Mehrabi, R. Bücker, G. Bourenkov, H. Ginn, D. von Stetten, H. M. Mueller-Werkmeister, A. Kuo, T. Morizumi, B. Eger, W.-L. Ou, S. Oghbaey, A. Sarracini, J. Besaw, O. Paré-Labrosse, S. Meier, H. Schikora, F. Tellkamp, A. Marx, D. A. Sherrell, D. Axford, R. L. Owen, O. P. Ernst, E. F. Pai, E.-C. Schulz, R. J. D. Miller
Science Advances 7 (12), eabf1380 (2021)
Journal Article
Environmental Liquid Cell Technique for Improved Electron Microscopic Imaging of Soft Matter in Solution
S. Azim, L. Bultema, M. de Kock, E. R. Osorio-Blanco, M. Calderón, J. Gonschior, J.-P. Leimkohl, F. Tellkamp, R. Bücker, E.-C. Schulz, S. Keskin, N. de Jonge, G. Kassier, R. J. D. Miller
Microscopy and Microanalysis 27 (1), 44–53 (2021)
2020
Journal Article
Serial synchrotron crystallography for time-resolved structural biology
A. R. Pearson, P. Mehrabi
Current Opinion in Structural Biology 65, 168–174 (2020)
Journal Article
Determining the radial distribution function of water using electron scattering: A key to solution phase chemistry
M. de Kock, S. Azim, G. Kassier, R. J. D. Miller
The Journal of Chemical Physics 153 (19), 194504 (2020)
Journal Article
The crystal structure of mycobacterial epoxide hydrolase A
E.-C. Schulz, S. R. Henderson, B. Illarionov, T. Crosskey, S. M. Southall, B. Krichel, C. Uetrecht, M. Fischer, M. Wilmanns
Scientific Reports 10 (1), 16539 (2020)
Journal Article
Photoinduced Vibrations Drive Ultrafast Structural Distortion in Lead Halide Perovskite
H.-G. Duan, V. Tiwari, A. Jha, G. R. Berdiyorov, A. Akimov, O. Vendrell, P. K. Nayak, H. J. Snaith, M. Thorwart, Z. Li, M. E. Madjet, R. J. D. Miller
Journal of the American Chemical Society 142 (39), 16569–16578 (2020)
Journal Article
Intermolecular vibrations mediate ultrafast singlet fission
H.-G. Duan, A. Jha, X. Li, V. Tiwari, H. Ye, P. K. Nayak, X.-L. Zhu, Z. Li, T. J. Martinez, M. Thorwart, R. J. D. Miller
Science Advances 6 (38), eabb0052 (2020)
Journal Article
Human γS-Crystallin–Copper Binding Helps Buffer against Aggregation Caused by Oxidative Damage
K. W. Roskamp, S. Azim, G. Kassier, B. Norton-Baker, M. A. Sprague-Piercy, R. J. D. Miller, R. W. Martin
Biochemistry 59 (25), 2371–2385 (2020)
Journal Article
Transient Raman Snapshots of the Twisted Intramolecular Charge Transfer State in a Stilbazolium Dye
S. Karmakar, A. Ambastha, A. Jha, A. Dharmadhikari, J. Dharmadhikari, R. Venkatramani, J. Dasgupta
The Journal of Physical Chemistry Letters 11 (12), 4842–4848 (2020)
Journal Article
Excited-State Vibronic Dynamics of Bacteriorhodopsin from Two-Dimensional Electronic Photon Echo Spectroscopy and Multiconfigurational Quantum Chemistry
S. Gozem, P. J. M. Johnson, A. Halpin, H. L. Luk, T. Morizumi, V. Prokhorenko, O. P. Ernst, M. Olivucci, R. J. D. Miller
The Journal of Physical Chemistry Letters 11 (10), 3889–3896 (2020)
Journal Article
Effect of Alkyl Side Chain Length on Intra- and Intermolecular Interactions of Terthiophene–Isoindigo Copolymers
N. A. Tegegne, Z. Abdissa, W. Mammo, T. Uchiyama, Y. Okada-Shudo, F. Galeotti, W. Porzio, M. R. Andersson, D. Schlettwein, V. Vohra, H. Schwoerer
Journal of Physical Chemistry C 124 (18), 9644–9655 (2020)
Journal Article
Intramolecular vibrations enhance the quantum efficiency of excitonic energy transfer
H.-G. Duan, P. Nalbach, R. J. D. Miller, M. Thorwart
Photosynthesis Research 144 (2), 137–145 (2020)
Journal Article
Compact Ho:YLF-pumped ZnGeP2-based optical parametric amplifiers tunable in the molecular fingerprint regime
S. Cheng, G. Chatterjee, F. Tellkamp, T. Lang, A. Ruehl, I. Hartl, R. J. D. Miller
Optics Letters 45 (8), 2255–2258 (2020)
Journal Article
Quantum biology revisited
J. Cao, R. J. Cogdell, D. F. Coker, H.-G. Duan, J. Hauer, U. Kleinekathöfer, T. L. C. Jansen, T. Mančal, R. J. D. Miller, J. P. Ogilvie, V. Prokhorenko, T. Renger, H.-S. Tan, R. Tempelaar, M. Thorwart, E. Thyrhaug, S. Westenhoff, D. Zigmantas
Science Advances 6 (14), eaaz4888 (2020)
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