MPSD Publications
Journal Article (111)
2015
Journal Article
Real-space grids and the Octopus code as tools for the development of new simulation approaches for electronic systems , , , , , , , , , , , , , , ,
Physical Chemistry Chemical Physics 17 (47), 31371–31396 (2015)
Journal Article
Direct observation of collective modes coupled to molecular orbital–driven charge transfer
S. Hayes, S. Keskin, G. Corthey, M. Hada, K. Pichugin, A. Marx, J. Hirscht, , , , , , , , , , , R. J. D. Miller
, Science 350 (6267), 1501–1505 (2015)
Journal Article
Kohn–Sham approach to quantum electrodynamical density-functional theory: Exact time-dependent effective potentials in real space
Proceedings of the National Academy of Sciences of the United States of America 112 (50), 15285–15290 (2015)
Journal Article
Ambient Mass Spectrometry Imaging with Picosecond Infrared Laser Ablation Electrospray Ionization (PIR-LAESI) , , , , , , , , , , ,
Analytical Chemistry 87 (24), 12071–12079 (2015)
Journal Article
Optical field terahertz amplitude modulation by graphene nanoribbons , , ,
Nanoscale 7 (45), 19012–19017 (2015)
Journal Article
Local vibrational coherences drive the primary photochemistry of vision , , ,
Nature Chemistry 7 (12), 980–986 (2015)
Journal Article
Overcoming bifurcation instability in high-repetition-rate Ho:YLF regenerative amplifiers
Optics Letters 40 (23), 5427–5430 (2015)
Journal Article
Beyond the Hubbard bands in strongly correlated lattice bosons ,
Physical Review A 92 (6), 063602 (2015)
Journal Article
Proposal for ultrafast switching of ferroelectrics using midinfrared pulses
Physical Review B 92 (21), 214303 (2015)
Journal Article
Effect of a Single Water Molecule on the Electronic Absorption by o- and p-Nitrophenolate: A Shift to the Red or to the Blue? , ,
The Journal of Physical Chemistry A 119 (47), 11498–11503 (2015)
Journal Article
Visualization of Multimerization and Self-Assembly of DNA-Functionalized Gold Nanoparticles Using In-Liquid Transmission Electron Microscopy
The Journal of Physical Chemistry Letters 6 (22), 4487–4492 (2015)
Journal Article
Element-Specific Characterization of Transient Electronic Structure of Solvated Fe(II) Complexes with Time-Resolved Soft X-ray Absorption Spectroscopy , , , ,
Accounts of Chemical Research 48 (11), 2957–2966 (2015)
Journal Article
Elucidating the Structure of Chiral Molecules by using Amplified Vibrational Circular Dichroism: From Theory to Experimental Realization
Domingos Sérgio R., , ,
ChemPhysChem 16 (16), 3363–3373 (2015)
Journal Article
Dynamics of screening in photodoped Mott insulators ,
Physical Review B 92 (19), 195123 (2015)
Journal Article
Exciton recombination in one-dimensional organic Mott insulators ,
Physical Review B 92 (20), 201104(R) (2015)
Journal Article
Stabilization of magnetic helix in exchange-coupled thin films ,
Scientific Reports 5, 16153 (2015)
Journal Article
If You Can Get a Crystal Structure, Why Bother with Anything Else? , ,
Synchrotron Radiation News 28 (6), 10–14 (2015)
Journal Article
Comparing XMCD and DFT with STM spin excitation spectroscopy for Fe and Co adatoms on Cu2N/Cu(100)
S. Loth, ,
, , , , , , , , , , , Physical Review B 92 (18), 184406 (2015)
Journal Article
Total correlations of the diagonal ensemble herald the many-body localization transition
C. Gogolin, , , ,
, Physical Review B 92 (18), 180202(R) (2015)
Journal Article
Engineering Photophenomena in Large, 3D Structures Composed of Self-Assembled van der Waals Heterostructure Flakes
A. Rubio, , ,
, , , , , , , , , , Advanced Optical Materials 3 (11), 1551–1556 (2015)
Journal Article
A modular and compact portable mini-endstation for high-precision, high-speed fixed target serial crystallography at FEL and synchrotron sources , , , , , ,
Journal of Synchrotron Radiation 22 (6), 1372–1378 (2015)
Journal Article
Strong-coupling electron-phonon superconductivity in noncentrosymmetric quasi-one-dimensional K2Cr3As3
Physical Review B 92 (17), 174501 (2015)
Journal Article
THz-Frequency Modulation of the Hubbard U in an Organic Mott Insulator
R. Singla, G. Cotugno, S. Kaiser, M. Först, M. Mitrano, H. Liu, A. Cartella, C. Manzoni, , , , , A. Cavalleri
Physical Review Letters 115 (18), 187401 (2015)
Journal Article
Insights into colour-tuning of chlorophyll optical response in green plants , , , , , , , ,
Physical Chemistry Chemical Physics 17 (40), 26599–26606 (2015)
Journal Article
The Soret absorption band of isolated chlorophyll a and b tagged with quaternary ammonium ions
A. Rubio, ,
, , , , , Physical Chemistry Chemical Physics 17 (39), 25793–25798 (2015)
Journal Article
The strength of electron electron correlation in Cs3C60
M. Mitrano, D. Nicoletti, , , , , , , ,
, , Scientific Reports 5, 15240 (2015)
Journal Article
Communication: X-ray coherent diffractive imaging by immersion in nanodroplets
R. Boll, , , L. Englert, S. W. Epp, B. Erk, L. Foucar, , , , D. Rolles, B. Rudek, A. Rudenko, , J. H. Ullrich, , , ,
, , , , , , Structural Dynamics 2 (5), 051102 (2015)
Journal Article
Terahertz-driven linear electron acceleration , , , , , ,
Nature Communications 6, 8486 (2015)
Journal Article
Efficient tool to calculate two-dimensional optical spectra for photoactive molecular complexes
Physical Review E 92 (4), 042708 (2015)
Journal Article
Quantum-beat Auger spectroscopy
Physical Review A 92 (4), 043420 (2015)
Journal Article
Nonthermal Melting of Néel Order in the Hubbard Model
K. Balzer, , , , M. Eckstein
Physical Review X 5 (3), 031039 (2015)
Journal Article
Ultrafast optical modification of exchange interactions in iron oxides
J. H. Mentink, M. Eckstein, , , , , ,
, , , Nature Communications 6, 8190 (2015)
Journal Article
Magnetic fingerprint of individual Fe4 molecular magnets under compression by a scanning tunnelling microscope
Nature Communications 6, 8216 (2015)
Journal Article
Two-Dimensional Electronic Spectroscopy of Light-Harvesting Complex II at Ambient Temperature: A Joint Experimental and Theoretical Study
The Journal of Physical Chemistry B 119 (36), 12017–12027 (2015)
Journal Article
Glucanocellulosic ethanol: the undiscovered biofuel potential in energy crops and marine biomass
D. Eggert, , , , , ,
, , Scientific Reports 5, 13722 (2015)
Journal Article
Supraleitung bei Raumtemperatur
Physik in Unserer Zeit 46 (5), 238–244 (2015)
Journal Article
A closed-loop pump-driven wire-guided flow jet for ultrafast spectroscopy of liquid samples
Review of Scientific Instruments 86 (9), 093105 (2015)
Journal Article
Spatially resolved ultrafast magnetic dynamics initiated at a complex oxide heterointerface
Nature Materials 14 (9), 883–888 (2015)
Journal Article
Tracking Primary Thermalization Events in Graphene with Photoemission at Extreme Time Scales
Physical Review Letters 115 (8), 086803 (2015)
Journal Article
Fixed target matrix for femtosecond time-resolved and in situ serial micro-crystallography ,
Structural Dynamics 2 (5), 054302 (2015)
Journal Article
Orbitals from local RDMFT: Are they Kohn-Sham or natural orbitals? , , ,
The Journal of Chemical Physics 143 (5), 054106 (2015)
Journal Article
Enhancing and controlling single-atom high-harmonic generation spectra: a time-dependent density-functional scheme ,
European Physical Journal B 88 (8), 191 (2015)
Journal Article
Single-photon excitation of Kα in heliumlike Kr34+: Results supporting quantum electrodynamics predictions
S. W. Epp, R. F. Steinbrügge, S. Bernitt, J. K. Rudolph, , H. Bekker, , O. Versolato, , , , J. R. Crespo López-Urrutia
Physical Review A 92 (2), 020502(R) (2015)
Journal Article
Note: A simple image processing based fiducial auto-alignment method for sample registration
Review of Scientific Instruments 86 (8), 086105 (2015)
Journal Article
Time-Dependent Thermal Transport Theory , ,
Physical Review Letters 115 (5), 056801 (2015)
Journal Article
On the origin of oscillations in two-dimensional spectra of excitonically-coupled molecular systems , ,
New Journal of Physics 17 (7), 072002 (2015)
Journal Article
Nano-beam X-ray microscopy of dried colloidal films , , , , ,
Soft Matter 11 (27), 5465–5472 (2015)
Journal Article
Towards instantaneous cellular level bio diagnosis: laser extraction and imaging of biological entities with conserved integrity and activity
Nanotechnology 26 (28), 284001 (2015)