Zeitschriftenartikel (1310)

2016
Zeitschriftenartikel
Communication: Structural locking mediated by a water wire: A high-resolution rotational spectroscopy study on hydrated forms of a chiral biphenyl derivative
The Journal of Chemical Physics 145 (16), 161103 (2016)
Zeitschriftenartikel
Negative plasmon dispersion in 2H-NbS2 beyond the charge-density-wave interpretation
P. Cudazzo, E. Müller, C. Habenicht, M. Gatti, H. Berger, M. Knupfer, A. Rubio, S. Huotari
New Journal of Physics 18 (10), 103050 (2016)
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Time-resolved single dopant charge dynamics in silicon
M. Rashidi, J. A. J. Burgess, M. Taucer, R. Achal, J. L. Pitters, S. Loth, R. A. Wolkow
Nature Communications 7, 13258 (2016)
Zeitschriftenartikel
Water-Induced Structural Changes in Crown Ethers from Broadband Rotational Spectroscopy
C. Pérez, J. C. López, S. Blanco, M. Schnell
The Journal of Physical Chemistry Letters 7 (20), 4053–4058 (2016)
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Electronic-structural dynamics in graphene
Structural Dynamics 3 (5), 051301 (2016)
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Controllable vacuum-induced diffraction of matter-wave superradiance using an all-optical dispersive cavity
S.-W. Su, Z.-K. Lu, S.-C. Gou, W.-T. Liao
Scientific Reports 6, 35402 (2016)
Zeitschriftenartikel
Stable monolayer honeycomb-like structures of RuX2 (X=S, Se)
F. Ersan, S. Cahangirov, G. Gökoğlu, A. Rubio, E. Aktürk
Physical Review B 94 (15), 155415 (2016)
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Synchronised photoreversion of spirooxazine ring opening in thin crystals to uncover ultrafast dynamics
CrystEngComm 18 (38), 7212–7216 (2016)
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Aromatic embedding wins over classical hydrogen bonding – a multi-spectroscopic approach for the diphenyl ether–methanol complex
C. Medcraft, S. Zinn, M. Schnell, A. Poblotzki, J. Altnöder, M. Heger, M. A. Suhm, D. Bernhard, A. Stamm, F. Dietrich, M. Gerhards
Physical Chemistry Chemical Physics 18 (37), 25975–25983 (2016)
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The elusive ≡C-H⋯O complex in the hydrogen bonded systems of Phenylacetylene: A Matrix Isolation Infrared and Ab Initio Study
G. Karir, M. Fatima, K. S. Viswanathan
Journal of Chemical Sciences 128 (10), 1557–1569 (2016)
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Nonlinear light–matter interaction at terahertz frequencies
Advances in Optics and Photonics 8 (3), 401–464 (2016)
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Synthesis of Bidimensional Prussian Blue Analogue Using an Inverted Langmuir–Schaefer Method
Langmuir 32 (38), 9706–9713 (2016)
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The Challenge of Thermal Deposition of Coordination Compounds: Insight into the Case of an Fe4 Single Molecule Magnet
V. Lanzilotto, L. Malavolti, S. Ninova, I. Cimatti, L. Poggini, B. Cortigiani, M. Mannini, F. Totti, A. Cornia, R. Sessoli
Chemistry of Materials 28 (21), 7693–7702 (2016)
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Atomic and electronic structure of trilayer graphene/SiC(0001): Evidence of Strong Dependence on Stacking Sequence and charge transfer
D. Pierucci, T. Brumme, J.-C. Girard, M. Calandra, M. G. Silly, F. Sirotti, A. Barbier, F. Mauri, A. Ouerghi
Scientific Reports 6, 33487 (2016)
Zeitschriftenartikel
Non-linear quantum-classical scheme to simulate non-equilibrium strongly correlated fermionic many-body dynamics
J. M. Kreula, S. R. Clark, D. Jaksch
Scientific Reports 6, 32940 (2016)
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Quantum plasmonics: from jellium models to ab initio calculations
A. Varas, P. García-González, J. Feist, F. J. García-Vidal, A. Rubio
Nanophotonics 5 (3), 409–426 (2016)
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Impact of Vibrational Coherence on the Quantum Yield at a Conical Intersection
The Journal of Physical Chemistry Letters 7 (17), 3491–3496 (2016)
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AXSIS: Exploring the frontiers in attosecond X-ray science, imaging and spectroscopy
F. X. Kärtner, F. Ahr, A.-L. Calendron, H. Çankaya, S. Carbajo, G. Chang, G. Cirmi, K. Dörner, U. Dorda, A. Fallahi, A. Hartin, M. Hemmer, R. Hobbs, Y. Hua, W. R. Huang, R. Letrun, N. Matlis, V. Mazalova, O. D. Mücke, E. Nanni, W. Putnam, K. Ravi, F. Reichert, I. Sarrou, X. Wu, A. Yahaghi, H. Ye, L. Zapata, D. Zhang, C. Zhou, R. J. D. Miller, K. K. Berggren, H. Graafsma, A. Meents, R. W. Assmann, H. N. Chapman, P. Fromme
Nuclear Instruments and Methods in Physics Research Section A: Accelerators, Spectrometers, Detectors and Associated Equipment 829, 24–29 (2016)
Zeitschriftenartikel
Noncovalent Dimerization after Enediyne Cyclization on Au(111)
D. G. de Oteyza, A. P. Paz, Y.-C. Chen, Z. Pedramrazi, A. Riss, S. Wickenburg, H.-Z. Tsai, F. R. Fischer, M. F. Crommie, A. Rubio
Journal of the American Chemical Society 138 (34), 10963–10967 (2016)
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Optical fiber-based photocathode
Applied Physics Letters 109 (9), 091105 (2016)
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Slowdown of the Electronic Relaxation Close to the Mott Transition
Physical Review Letters 117 (9), 096403 (2016)
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Time-dependent density functional theory beyond Kohn–Sham Slater determinants
J. I. Fuks, S. E. B. Nielsen, M. Ruggenthaler, N. T. Maitra
Physical Chemistry Chemical Physics 18 (31), 20976–20985 (2016)
Zeitschriftenartikel
Systematic construction of density functionals based on matrix product state computations
New Journal of Physics 18 (8), 083039 (2016)
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Disentangling Vacancy Oxidation on Metallicity-Sorted Carbon Nanotubes
D. J. Mowbray, A. Pérez Paz, G. Ruiz-Soria, M. Sauer, P. Lacovig, M. Dalmiglio, S. Lizzit, K. Yanagi, A. Goldoni, P. Ayala, T. Pichler, A. Rubio
The Journal of Physical Chemistry C 120 (32), 18316–18322 (2016)
Zeitschriftenartikel
Structural and magnetic properties of FeMnx chains (x=1–6) supported on Cu2N / Cu (100)
D.-J. Choi, R. Robles, J.-P. Gauyacq, M. Ternes, S. Loth, N. Lorente
Physical Review B 94 (8), 085406 (2016)
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Special issue on imaging the dynamic structure of matter
H. Schwoerer, H. N. Chapman, B. J. Siwick, R. J. D. Miller
Journal of Physics B: Atomic, Molecular and Optical Physics 49 (15), 150201 (2016)
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Theoretical Study of the Photophysics of 8-Vinylguanine, an Isomorphic Fluorescent Analogue of Guanine
The Journal of Physical Chemistry A 120 (31), 6200–6215 (2016)
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Nanoscale Structure, Dynamics, and Aging Behavior of Metallic Glass Thin Films
J. A. J. Burgess, C. M. B. Holt, E. J. Luber, D. C. Fortin, G. Popowich, B. Zahiri, P. Concepcion, D. Mitlin, M. R. Freeman
Scientific Reports 6, 30973 (2016)
Zeitschriftenartikel
Few-qubit quantum-classical simulation of strongly correlated lattice fermions
J. M. Kreula, L. García-Álvarez, L. Lamata, S. R. Clark, E. Solano, D. Jaksch
EPJ Quantum Technology 3, 11 (2016)
Zeitschriftenartikel
The adiabatic limit of the exact factorization of the electron-nuclear wave function
F. G. Eich, F. Agostini
The Journal of Chemical Physics 145 (5), 054110 (2016)
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Dual Luminescence, Interligand Decay, and Nonradiative Electronic Relaxation of Cyclometalated Iridium Complexes in Solution
E. Pomarico, M. Silatani, F. Messina, O. Braem, A. Cannizzo, E. Barranoff, J. H. Klein, C. Lambert, M. Chergui
The Journal of Physical Chemistry C 120 (30), 16459–16469 (2016)
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Stability of the Dirac cone in artificial graphene formed in quantum wells: a computational many-electron study
I. Kylänpää, F. Berardi, E. Räsänen, P. García-González, C. A. Rozzi, A. Rubio
New Journal of Physics 18 (8), 083014 (2016)
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Josephson plasmonics in layered superconductors
Advances in Physics: X 1 (3), 387–411 (2016)
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Single-shot diffraction data from the Mimivirus particle using an X-ray free-electron laser
T. Ekeberg, M. Svenda, M. M. Seibert, C. Abergel, F. R. N. C. Maia, V. Seltzer, D. P. DePonte, A. Aquila, J. Andreasson, B. Iwan, O. Jönsson, D. Westphal, D. Odić, I. Andersson, A. Barty, M. Liang, A. V. Martin, L. Gumprecht, H. Fleckenstein, S. Bajt, M. Barthelmess, N. Coppola, J.-M. Claverie, N. D. Loh, C. Bostedt, J. D. Bozek, J. Krzywinski, M. Messerschmidt, M. J. Bogan, C. Y. Hampton, R. G. Sierra, M. Frank, R. L. Shoeman, L. Lomb, L. Foucar, S. Epp, D. Rolles, A. Rudenko, R. Hartmann, A. Hartmann, N. Kimmel, P. Holl, G. Weidenspointner, B. Rudek, B. Erk, S. Kassemeyer, I. Schlichting, L. Strüder, J. Ullrich, C. Schmidt, F. Krasniqi, G. Hauser, C. Reich, H. Soltau, S. Schorb, H. Hirsemann, C. Wunderer, H. Graafsma, H. Chapman, J. Hajdu
Scientific Data 3, 160060 (2016)
Zeitschriftenartikel
A data set from flash X-ray imaging of carboxysomes
M. F. Hantke, D. Hasse, T. Ekeberg, K. John, M. Svenda, D. Loh, A. V. Martin, N. Timneanu, D. S. D. Larsson, G. van der Schot, G. H. Carlsson, M. Ingelman, J. Andreasson, D. Westphal, B. Iwan, C. Uetrecht, J. Bielecki, M. Liang, F. Stellato, D. P. DePonte, S. Bari, R. Hartmann, N. Kimmel, R. A. Kirian, M. M. Seibert, K. Mühlig, S. Schorb, K. Ferguson, C. Bostedt, S. Carron, J. D. Bozek, D. Rolles, A. Rudenko, L. Foucar, S. W. Epp, H. N. Chapman, A. Barty, I. Andersson, J. Hajdu, F. R. N. C. Maia
Scientific Data 3, 160061 (2016)
Zeitschriftenartikel
Exact maps in density functional theory for lattice models
New Journal of Physics 18 (8), 083004 (2016)
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TakeTwo: an indexing algorithm suited to still images with known crystal parameters
H. M. Ginn, P. Roedig, A. Kuo, G. Evans, N. K. Sauter, O. Ernst, A. Meents, H. Müller-Werkmeister, R. J. D. Miller, D. I. Stuart
Acta Crystallographica Section D: Structural Biology 72 (8), 956–965 (2016)
Zeitschriftenartikel
Fixed target combined with spectral mapping: approaching 100% hit rates for serial crystallography
S. Oghbaey, A. Sarracini, H. M. Ginn, O. Pare-Labrosse, A. Kuo, A. Marx, S. W. Epp, D. A. Sherrell, B. T. Eger, Y. P. Zhong, R. Loch, V. Mariani, R. Alonso-Mori, S. Nelson, H. T. Lemke, R. L. Owen, A. R. Pearson, D. I. Stuart, O. P. Ernst, H. Müller-Werkmeister, R. J. D. Miller
Acta Crystallographica Section D: Structural Biology 72 (8), 944–955 (2016)
Zeitschriftenartikel
Photoinduced gap closure in an excitonic insulator
D. Golež, P. Werner, M. Eckstein
Physical Review B 94 (3), 035121 (2016)
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Bandgap Modulation in Photoexcited Topological Insulator Bi2Te3 via Atomic Displacements
M. Hada, K. Norimatsu, S. Tanaka, S. Keskin, T. Tsuruta, K. Igarashi, T. Ishikawa, Y. Kayanuma, R. J. D. Miller, K. Onda, T. Sasagawa, S.-ya Koshihara, K. G. Nakamura
The Journal of Chemical Physics 145 (2), 024504 (2016)
Zeitschriftenartikel
Role of heat accumulation in the multi-shot damage of silicon irradiated with femtosecond XUV pulses at a 1 MHz repetition rate
R. Sobierajski, I. Jacyna, P. Dłużewski, M. T. Klepka, D. Klinger, J. B. Pełka, T. Burian, V. Hájková, L. Juha, K. Saksl, V. Vozda, I. Makhotkin, E. Louis, B. Faatz, K. Tiedtke, S. Toleikis, H. Enkisch, M. Hermann, S. Strobel, R. Loch, J. Chalupsky
Optics Express 24 (14), 15468–15477 (2016)
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Flexibility unleashed in acyclic monoterpenes: conformational space of citronellal revealed by broadband rotational spectroscopy
Physical Chemistry Chemical Physics 18 (25), 16682–16689 (2016)
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The Conformational Map of Volatile Anesthetics: Enflurane Revisited
C. Pérez, E. Caballero-Mancebo, A. Lesarri, E. J. Cocinero, I. Alkorta, R. D. Suenram, J.-U. Grabow, B. H. Pate
Chemistry – A European Journal 22 (28), 9804–9811 (2016)
Zeitschriftenartikel
Imaging single-molecule reaction intermediates stabilized by surface dissipation and entropy
A. Riss, A. P. Paz, S. Wickenburg, H.-Z. Tsai, D. G. D. Oteyza, A. J. Bradley, M. M. Ugeda, P. Gorman, H. S. Jung, M. F. Crommie, A. Rubio, F. R. Fischer
Nature Chemistry 8 (7), 678–683 (2016)
Zeitschriftenartikel
Electronic and Molecular Structure of the Transient Radical Photocatalyst Mn(CO)5 and Its Parent Compound Mn2(CO)10
H. Cho, K. Hong, M. L. Strader, J. H. Lee, R. W. Schoenlein, N. Huse, T. K. Kim
Inorganic Chemistry 55 (12), 5895–5903 (2016)
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Electronic Structure of Low-Dimensional Carbon π-Systems
J. M. Garcia-Lastra, I. Boukahil, R. Qiao, A. Rubio, F. J. Himpsel
The Journal of Physical Chemistry C 120 (23), 12362–12368 (2016)
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Improved ab initio calculation of surface second-harmonic generation from Si(111)(1×1):H
S. M. Anderson, N. Tancogne-Dejean, B. S. Mendoza, V. Véniard
Physical Review B 93 (23), 235304 (2016)
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Stable Dirac semimetal in the allotropes of group-IV elements
W. Cao, P. Tang, S.-C. Zhang, W. Duan, A. Rubio
Physical Review B 93 (24), 241117(R) (2016)
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Nonequilibrium self-energy functional approach to the dynamical Mott transition
F. Hofmann, M. Eckstein, M. Potthoff
Physical Review B 93 (23), 235104 (2016)
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Conditions for Describing Triplet States in Reduced Density Matrix Functional Theory
I. Theophilou, N. N. Lathiotakis, N. Helbig
Journal of Chemical Theory and Computation 12 (6), 2668–2678 (2016)
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