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Benjamin E. Van Kuiken
Benjamin E. Van Kuiken
European XFEL
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Linear-response and real-time time-dependent density functional theory studies of core-level near-edge x-ray absorption
K Lopata, BE Van Kuiken, M Khalil, N Govind
Journal of chemical theory and computation 8 (9), 3284-3292, 2012
2622012
An efficient method for calculating dynamical hyperpolarizabilities using real-time time-dependent density functional theory
F Ding, BE Van Kuiken, BE Eichinger, X Li
The Journal of chemical physics 138 (6), 2013
942013
Probing the Photoinduced Metal− Nitrosyl Linkage Isomerism of Sodium Nitroprusside in Solution Using Transient Infrared Spectroscopy
MS Lynch, M Cheng, BE Van Kuiken, M Khalil
Journal of the American Chemical Society 133 (14), 5255-5262, 2011
712011
Time-resolved X-ray spectroscopy in the water window: elucidating transient valence charge distributions in an aqueous Fe (II) complex
BE Van Kuiken, H Cho, K Hong, M Khalil, RW Schoenlein, TK Kim, ...
The Journal of Physical Chemistry Letters 7 (3), 465-470, 2016
702016
Simulating Ru L3-Edge X-ray Absorption Spectroscopy with Time-Dependent Density Functional Theory: Model Complexes and Electron Localization in Mixed …
BE Van Kuiken, M Valiev, SL Daifuku, C Bannan, ML Strader, H Cho, ...
The Journal of Physical Chemistry A 117 (21), 4444-4454, 2013
682013
Probing the Electronic Structure of a Photoexcited Solar Cell Dye with Transient X-ray Absorption Spectroscopy
BE Van Kuiken, N Huse, H Cho, ML Strader, MS Lynch, RW Schoenlein, ...
The Journal of Physical Chemistry Letters 3, 1695, 2012
682012
A laboratory spectrometer for high throughput X-ray emission spectroscopy in catalysis research
W Malzer, D Grötzsch, R Gnewkow, C Schlesiger, F Kowalewski, ...
Review of Scientific Instruments 89 (11), 2018
492018
Ultrafast Independent N− H and N− C Bond Deformation Investigated with Resonant Inelastic X‐Ray Scattering
S Eckert, J Norell, PS Miedema, M Beye, M Fondell, W Quevedo, ...
Angewandte Chemie International Edition 56 (22), 6088-6092, 2017
372017
Simulating picosecond iron K-edge X-ray absorption spectra by ab initio methods to study photoinduced changes in the electronic structure of Fe (II) spin crossover complexes
BE Van Kuiken, M Khalil
The Journal of Physical Chemistry A 115 (39), 10749-10761, 2011
352011
On the Role of High-Frequency Intramolecular Vibrations in Ultrafast Back-Electron Transfer Reactions
MS Lynch, BE Van Kuiken, SL Daifuku, M Khalil
The Journal of Physical Chemistry Letters, 2011
352011
Benchmarking the performance of density functional theory based Green’s function formalism utilizing different self-energy models in calculating electronic transmission through …
A Prociuk, B Van Kuiken, BD Dunietz
The Journal of chemical physics 125 (20), 2006
352006
A guided self-consistent-field method for excited-state wave function optimization: Applications to ligand-field transitions in transition-metal complexes
B Peng, BE Van Kuiken, F Ding, X Li
Journal of Chemical Theory and Computation 9 (9), 3933-3938, 2013
322013
Probing Physical Oxidation State by Resonant X‐ray Emission Spectroscopy: Applications to Iron Model Complexes and Nitrogenase
RG Castillo, AW Hahn, BE Van Kuiken, JT Henthorn, J McGale, S DeBeer
Angewandte Chemie 133 (18), 10200-10209, 2021
312021
Measuring spin-allowed and spin-forbidden d–d excitations in vanadium complexes with 2p3d resonant inelastic X-ray scattering
BE Van Kuiken, AW Hahn, D Maganas, S DeBeer
Inorganic chemistry 55 (21), 11497-11501, 2016
312016
Investigating vibrational anharmonic couplings in cyanide-bridged transition metal mixed valence complexes using two-dimensional infrared spectroscopy
KM Slenkamp, MS Lynch, BE Van Kuiken, JF Brookes, CC Bannan, ...
The Journal of Chemical Physics 140 (8), 2014
312014
Probing the valence electronic structure of low-spin ferrous and ferric complexes using 2p3d resonant inelastic X-ray scattering (RIXS)
AW Hahn, BE Van Kuiken, VG Chilkuri, N Levin, E Bill, T Weyhermüller, ...
Inorganic Chemistry 57 (15), 9515-9530, 2018
302018
Multiadsorption and coadsorption of hydrogen on model conjugated systems
M Wong, BE Van Kuiken, C Buda, BD Dunietz
The Journal of Physical Chemistry C 113 (28), 12571-12579, 2009
262009
Calcium valence-to-core X-ray emission spectroscopy: A sensitive probe of oxo protonation in structural models of the oxygen-evolving complex
Z Mathe, DA Pantazis, HB Lee, R Gnewkow, BE Van Kuiken, T Agapie, ...
Inorganic Chemistry 58 (23), 16292-16301, 2019
252019
Nonequilibrium sub–10 nm spin-wave soliton formation in FePt nanoparticles
D Turenne, A Yaroslavtsev, X Wang, V Unikandanuni, I Vaskivskyi, ...
Science advances 8 (13), eabn0523, 2022
232022
The soft X-ray monochromator at the SASE3 beamline of the European XFEL: from design to operation
N Gerasimova, D La Civita, L Samoylova, M Vannoni, R Villanueva, ...
Journal of Synchrotron Radiation 29 (5), 1299-1308, 2022
222022
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